Results for:
Species: Serratia spp.

Acetic Acid

Mass-Spectra

Compound Details

Synonymous names
Methanecarboxylate
Methanecarboxylic acid
aceticacid
Carboxymethyl Group
Essigsaeure
Somatorelin acetate
Acetasol
Azijnzuur
Ethylate
Pyroligneous acid
QTBSBXVTEAMEQO-UHFFFAOYSA-N
Somatrel
Glacial acetate
Kyselina octova
MeCOOH
Shotgun
Vinegar
Volsol
acetyl alcohol
Acide acetique
Acido acetico
AcOH
ethanoic acid
Glacial Acetic
HOAc
methane carboxylic acid
Orlex
Otic Domeboro
Vosol
acetic acid
acetic-acid
ACY
CH3COOH
Ethanoic acid monomer
ethoic acid
Ethylic acid
Ghrh acetate
Grf sumitomo
Octowy kwas
Undiluted Acetic Acid
Vinegar acid
Acetic acid glacial
Acetic Acid Natural
Glacial acetic acid
MeCO2H
AC1Q2BPJ
Aci-jel
10.Methanecarboxylic acid
Acetic acid, analytical standard
Acetic acid, Environmental Grade
CH3CO2H
acetic -acid
acetic acid-
CH3-COOH
CHEMBL539
Sodium acetate, anhydrous or trihydrate
AC1L18NC
Acetic acid, aqueous solution
Acetic acid, diluted
Acetic acid, Environmental Grade Plus
Acetic acid, glacial
Acetic acid, propionic acid distillate
Acetic acid, water solutions
Bifido Selective Supplement B, for microbiology
Essigsaeure [German]
Acetic acid, purified by double-distillation
Azijnzuur [Dutch]
Glacial acetic acid, meets USP testing specifications
Acetic acid, ACS reagent
E260
GTPL1058
HSDB 40
KSC491S8N
METHYL, CARBOXY-
Nat. Acetic Acid
Somatorelin acetate [JAN]
UNII-N4G9GAT76C component QTBSBXVTEAMEQO-UHFFFAOYSA-N
Acetasol (TN)
Acetic Acid (Recovered)
Acetic Acid, Glacial Reagent ACS
Acide acetique [French]
Acido acetico [Italian]
ACMC-1B1E4
Kyselina octova [Czech]
PubChem22173
UN2789
UN2790
Acetic acid (natural)
Acetic acid solution, for HPLC
C2:0
CTK3J1986
HMDB00042
Octowy kwas [Polish]
WLN: QV1
Y1308
Glacial Acetic Acid, pharmaceutical secondary standard; traceable to USP
RL04447
Somatorelin acetate [WHO-DD]
Vinegar (Salt/Mix)
Acetic acid [JAN]
ACETIC ACID, GLACIAL, ACS
bmse000191
bmse000817
bmse000857
C00033
CCRIS 5952
D00010
E 260
E-260
Q40Q9N063P
UNII-XY920R6F5N
Acetic acid, Glacial, ACS Reagent
BC253535
DTXSID5024394
FEMA Number 2006
IN012302
LS-1541
LS-2535
NSC132953
NSC406306
OR034264
OR034746
Otic Domeboro (Salt/Mix)
STL264240
UN 2789
A834671
Carboxylic acids, C2-3
CHEBI:15366
DSSTox_CID_4394
UNII-Q40Q9N063P
ZINC5224164
Acetic acid, 0.1N Standardized Solution
Acetic acid, 1.0N Standardized Solution
AN-41867
ANW-41557
ANW-44008
DSSTox_GSID_24394
KB-47052
MO 08470
Acetic acid, glacial (USP)
BDBM50074329
Caswell No. 003
DSSTox_RID_77386
Glacial acetic acid, United States Pharmacopeia (USP) Reference Standard
LMFA01010002
MFCD00036152
AI3-02394
Glacial acetic acid (JP17)
NCIOpen2_000659
NCIOpen2_000682
NSC 132953
NSC-132953
NSC-406306
RTR-021046
TR-021046
TR-021753
Acetic acid 0.25% in plastic container
Acetic acid, >=99.7%
Acetic acid, 1% v/v aqueous solution
Acetic acid, 4% v/v aqueous solution
Acetic acid, glacial [USAN:JAN]
AKOS000268789
EPA Pesticide Chemical Code 044001
I04-9818
INS No. 260
Acetic acid (JP17/NF)
Acetic acid, Acculute Standard Volumetric Solution, Final Concentration 1.0N
BRN 0506007
FEMA No. 2006
FT-0613051
FT-0619087
FT-0621735
FT-0638674
FT-0659639
TCLP extraction fluid 2 (Salt/Mix)
TRA-0196378
64-19-7
I14-60089
Somatoliberin (human pancreatic islet), acetate (salt)
Acetic acid, puriss., >=80%
Tox21_301453
Acetic acid, 99.8%, anhydrous
Acetic acid, ReagentPlus(R), >=99%
CAS-64-19-7
Acetic acid, >=99.99% trace metals basis
Acetic acid, glacial, >=99.85%
MCULE-8295936189
NCGC00255303-01
Acetic acid, ACS reagent, >=99.7%
Acetic acid, AR, >=99.8%
Acetic acid, LR, >=99.5%
Acetic acid, UV HPLC spectroscopic, 99.9%
EINECS 200-580-7
68475-71-8
77671-22-8
Acetic acid, for HPLC, >=99.8%
Acetic acid, JIS special grade, >=99.7%
Acetic acid, Vetec(TM) reagent grade, >=99%
UN 2790 (Salt/Mix)
612-EP0930075A1
612-EP1441224A2
612-EP2269610A2
612-EP2269977A2
612-EP2269978A2
612-EP2269985A2
612-EP2269986A1
612-EP2269988A2
612-EP2269989A1
612-EP2269990A1
612-EP2269991A2
612-EP2269992A1
612-EP2269993A1
612-EP2269994A1
612-EP2269998A2
612-EP2270001A1
612-EP2270002A1
612-EP2270006A1
612-EP2270008A1
612-EP2270010A1
612-EP2270011A1
612-EP2270012A1
612-EP2270013A1
612-EP2270014A1
612-EP2270015A1
612-EP2270016A1
612-EP2270018A1
612-EP2270113A1
612-EP2270505A1
612-EP2272509A1
612-EP2272516A2
612-EP2272517A1
612-EP2272537A2
612-EP2272813A2
612-EP2272817A1
612-EP2272822A1
612-EP2272825A2
612-EP2272827A1
612-EP2272831A1
612-EP2272832A1
612-EP2272834A1
612-EP2272835A1
612-EP2272841A1
612-EP2272842A1
612-EP2272847A1
612-EP2272848A1
612-EP2272849A1
612-EP2272935A1
612-EP2272972A1
612-EP2272973A1
612-EP2274983A1
612-EP2275102A1
612-EP2275105A1
612-EP2275401A1
612-EP2275403A1
612-EP2275404A1
612-EP2275407A1
612-EP2275409A1
612-EP2275410A1
612-EP2275411A2
612-EP2275412A1
612-EP2275413A1
612-EP2275414A1
612-EP2275417A2
612-EP2275420A1
612-EP2275421A1
612-EP2275469A1
612-EP2277507A1
612-EP2277622A1
612-EP2277848A1
612-EP2277858A1
612-EP2277861A1
612-EP2277862A2
612-EP2277864A1
612-EP2277866A1
612-EP2277867A2
612-EP2277871A1
612-EP2277872A1
612-EP2277874A1
612-EP2277875A2
612-EP2277877A1
612-EP2277878A1
612-EP2277880A1
612-EP2277881A1
612-EP2279750A1
612-EP2280000A1
612-EP2280001A1
612-EP2280003A2
612-EP2280004A1
612-EP2280006A1
612-EP2280008A2
612-EP2280009A1
612-EP2280010A2
612-EP2280012A2
612-EP2280013A1
612-EP2280020A1
612-EP2280021A1
612-EP2281563A1
612-EP2281813A1
612-EP2281815A1
612-EP2281817A1
612-EP2281818A1
612-EP2281819A1
612-EP2281820A2
612-EP2281821A1
612-EP2281823A2
612-EP2281824A1
612-EP2284146A2
612-EP2284147A2
612-EP2284149A1
612-EP2284150A2
612-EP2284151A2
612-EP2284152A2
612-EP2284153A2
612-EP2284155A2
612-EP2284156A2
612-EP2284157A1
612-EP2284159A1
612-EP2284160A1
612-EP2284161A1
612-EP2284162A2
612-EP2284163A2
612-EP2284164A2
612-EP2284167A2
612-EP2284168A2
612-EP2284169A1
612-EP2284170A1
612-EP2284174A1
612-EP2284178A2
612-EP2284179A2
612-EP2284920A1
612-EP2286795A1
612-EP2286811A1
612-EP2287140A2
612-EP2287147A2
612-EP2287148A2
612-EP2287150A2
612-EP2287152A2
612-EP2287153A1
612-EP2287155A1
612-EP2287156A1
612-EP2287160A1
612-EP2287161A1
612-EP2287162A1
612-EP2287163A1
612-EP2287165A2
612-EP2287166A2
612-EP2287167A1
612-EP2287940A1
612-EP2289509A2
612-EP2289510A1
612-EP2289518A1
612-EP2289868A1
612-EP2289876A1
612-EP2289879A1
612-EP2289883A1
612-EP2289885A1
612-EP2289890A1
612-EP2289892A1
612-EP2289893A1
612-EP2289894A2
612-EP2289897A1
612-EP2289965A1
612-EP2292088A1
612-EP2292227A2
612-EP2292228A1
612-EP2292231A1
612-EP2292233A2
612-EP2292234A1
612-EP2292576A2
612-EP2292586A2
612-EP2292589A1
612-EP2292590A2
612-EP2292592A1
612-EP2292593A2
612-EP2292595A1
612-EP2292596A2
612-EP2292597A1
612-EP2292599A1
612-EP2292602A1
612-EP2292603A1
612-EP2292604A2
612-EP2292606A1
612-EP2292610A1
612-EP2292611A1
612-EP2292615A1
612-EP2292617A1
612-EP2292619A1
612-EP2292620A2
612-EP2292621A1
612-EP2292622A1
612-EP2292628A2
612-EP2295053A1
612-EP2295055A2
612-EP2295401A2
612-EP2295402A2
612-EP2295406A1
612-EP2295409A1
612-EP2295411A1
612-EP2295412A1
612-EP2295413A1
612-EP2295414A1
612-EP2295415A1
612-EP2295416A2
612-EP2295417A1
612-EP2295418A1
612-EP2295419A2
612-EP2295421A1
612-EP2295423A1
612-EP2295425A1
612-EP2295426A1
612-EP2295427A1
612-EP2295430A2
612-EP2295431A2
612-EP2295432A1
612-EP2295433A2
612-EP2295434A2
612-EP2295437A1
612-EP2295438A1
612-EP2295439A1
612-EP2295441A2
612-EP2295503A1
612-EP2298312A1
612-EP2298729A1
612-EP2298731A1
612-EP2298734A2
612-EP2298735A1
612-EP2298742A1
612-EP2298743A1
612-EP2298744A2
612-EP2298745A1
612-EP2298746A1
612-EP2298747A1
612-EP2298748A2
612-EP2298750A1
612-EP2298754A1
612-EP2298755A1
612-EP2298756A1
612-EP2298757A2
612-EP2298758A1
612-EP2298759A1
612-EP2298761A1
612-EP2298763A1
612-EP2298766A1
612-EP2298767A1
612-EP2298768A1
612-EP2298770A1
612-EP2298771A2
612-EP2298772A1
612-EP2298775A1
612-EP2298776A1
612-EP2298777A2
612-EP2298778A1
612-EP2298779A1
612-EP2298780A1
612-EP2298828A1
612-EP2301533A1
612-EP2301534A1
612-EP2301536A1
612-EP2301538A1
612-EP2301544A1
612-EP2301912A2
612-EP2301916A2
612-EP2301918A1
612-EP2301922A1
612-EP2301923A1
612-EP2301928A1
612-EP2301929A1
612-EP2301931A1
612-EP2301933A1
612-EP2301934A1
612-EP2301935A1
612-EP2301937A1
612-EP2301938A1
612-EP2301939A1
612-EP2301940A1
612-EP2301983A1
612-EP2302382A2
612-EP2302383A2
612-EP2305219A1
612-EP2305248A1
612-EP2305250A1
612-EP2305254A1
612-EP2305257A1
612-EP2305260A1
612-EP2305627A1
612-EP2305633A1
612-EP2305636A1
612-EP2305637A2
612-EP2305640A2
612-EP2305641A1
612-EP2305643A1
612-EP2305646A1
612-EP2305647A1
612-EP2305648A1
612-EP2305649A1
612-EP2305650A1
612-EP2305651A1
612-EP2305652A2
612-EP2305653A1
612-EP2305654A1
612-EP2305655A2
612-EP2305657A2
612-EP2305659A1
612-EP2305660A1
612-EP2305662A1
612-EP2305663A1
612-EP2305664A1
612-EP2305666A1
612-EP2305667A2
612-EP2305668A1
612-EP2305670A1
612-EP2305671A1
612-EP2305672A1
612-EP2305673A1
612-EP2305674A1
612-EP2305675A1
612-EP2305676A1
612-EP2305678A1
612-EP2305679A1
612-EP2305681A1
612-EP2305682A1
612-EP2305683A1
612-EP2305684A1
612-EP2305687A1
612-EP2305689A1
612-EP2305695A2
612-EP2305696A2
612-EP2305697A2
612-EP2305698A2
612-EP2305769A2
612-EP2305808A1
612-EP2305825A1
612-EP2308479A2
612-EP2308492A1
612-EP2308510A1
612-EP2308562A2
612-EP2308812A2
612-EP2308828A2
612-EP2308831A1
612-EP2308833A2
612-EP2308838A1
612-EP2308839A1
612-EP2308841A2
612-EP2308842A1
612-EP2308847A1
612-EP2308848A1
612-EP2308849A1
612-EP2308850A1
612-EP2308851A1
612-EP2308854A1
612-EP2308855A1
612-EP2308857A1
612-EP2308858A1
612-EP2308861A1
612-EP2308864A1
612-EP2308865A1
612-EP2308867A2
612-EP2308869A1
612-EP2308870A2
612-EP2308872A1
612-EP2308873A1
612-EP2308874A1
612-EP2308875A1
612-EP2308877A1
612-EP2308879A1
612-EP2308880A1
612-EP2308882A1
612-EP2308883A1
612-EP2308960A1
612-EP2309584A1
612-EP2311451A1
612-EP2311453A1
612-EP2311455A1
612-EP2311494A1
612-EP2311796A1
612-EP2311797A1
612-EP2311798A1
612-EP2311799A1
612-EP2311801A1
612-EP2311802A1
612-EP2311803A1
612-EP2311805A1
612-EP2311806A2
612-EP2311807A1
612-EP2311808A1
612-EP2311809A1
612-EP2311810A1
612-EP2311811A1
612-EP2311814A1
612-EP2311816A1
612-EP2311817A1
612-EP2311818A1
612-EP2311820A1
612-EP2311821A1
612-EP2311822A1
612-EP2311823A1
612-EP2311824A1
612-EP2311825A1
612-EP2311826A2
612-EP2311827A1
612-EP2311829A1
612-EP2311830A1
612-EP2311831A1
612-EP2311834A1
612-EP2311835A1
612-EP2311837A1
612-EP2311838A1
612-EP2311839A1
612-EP2311840A1
612-EP2311842A2
612-EP2311850A1
612-EP2314295A1
612-EP2314571A2
612-EP2314574A1
612-EP2314575A1
612-EP2314576A1
612-EP2314577A1
612-EP2314578A1
612-EP2314579A1
612-EP2314581A1
612-EP2314582A1
612-EP2314583A1
612-EP2314585A1
612-EP2314586A1
612-EP2314587A1
612-EP2314588A1
612-EP2314589A1
612-EP2314590A1
612-EP2314593A1
612-EP2315303A1
612-EP2316450A1
612-EP2316452A1
612-EP2316457A1
612-EP2316458A1
612-EP2316459A1
612-EP2316824A1
612-EP2316825A1
612-EP2316826A1
612-EP2316827A1
612-EP2316828A1
612-EP2316829A1
612-EP2316831A1
612-EP2316834A1
612-EP2316835A1
612-EP2316836A1
612-EP2316837A1
612-EP2316905A1
612-EP2316906A2
612-EP2316937A1
612-EP2371797A1
612-EP2371798A1
612-EP2371799A1
612-EP2371800A1
612-EP2371802A1
612-EP2371803A1
612-EP2371804A1
612-EP2371810A1
612-EP2371811A2
612-EP2371814A1
612-EP2372017A1
612-EP2374454A1
612-EP2374526A1
612-EP2374538A1
612-EP2374786A1
612-EP2374895A1
612-EP2377510A1
612-EP2377842A1
612-EP2377843A1
612-EP2380568A1
612-EP2380661A2
612-EP2380867A1
612-EP2380874A2
Acetic acid, SAJ first grade, >=99.0%
SR-01000944354
834904-91-5
Acetic acid solution, 1 M, 1 N
Acetic acid, >=99.7%, SAJ super special grade
Acetic acid, >=99.7%, suitable for amino acid analysis
8426-EP2269978A2
8426-EP2269985A2
8426-EP2269991A2
8426-EP2270001A1
8426-EP2270006A1
8426-EP2272509A1
8426-EP2272825A2
8426-EP2272848A1
8426-EP2275102A1
8426-EP2275105A1
8426-EP2275403A1
8426-EP2275413A1
8426-EP2275421A1
8426-EP2277848A1
8426-EP2277867A2
8426-EP2277874A1
8426-EP2280003A2
8426-EP2280008A2
8426-EP2281819A1
8426-EP2284150A2
8426-EP2284151A2
8426-EP2284152A2
8426-EP2284153A2
8426-EP2284155A2
8426-EP2284156A2
8426-EP2284157A1
8426-EP2284164A2
8426-EP2286811A1
8426-EP2286812A1
8426-EP2287140A2
8426-EP2287148A2
8426-EP2287150A2
8426-EP2287156A1
8426-EP2289893A1
8426-EP2292589A1
8426-EP2292593A2
8426-EP2292603A1
8426-EP2292604A2
8426-EP2295409A1
8426-EP2295410A1
8426-EP2295412A1
8426-EP2295413A1
8426-EP2295419A2
8426-EP2295428A2
8426-EP2295432A1
8426-EP2295433A2
8426-EP2295437A1
8426-EP2295503A1
8426-EP2298312A1
8426-EP2298743A1
8426-EP2298762A2
8426-EP2298770A1
8426-EP2298775A1
8426-EP2298776A1
8426-EP2298780A1
8426-EP2298783A1
8426-EP2301928A1
8426-EP2301930A1
8426-EP2301933A1
8426-EP2301940A1
8426-EP2305250A1
8426-EP2305637A2
8426-EP2305640A2
8426-EP2305660A1
8426-EP2305682A1
8426-EP2305689A1
8426-EP2305695A2
8426-EP2305696A2
8426-EP2305697A2
8426-EP2305698A2
8426-EP2308840A1
8426-EP2308841A2
8426-EP2308861A1
8426-EP2308867A2
8426-EP2308870A2
8426-EP2308879A1
8426-EP2311806A2
8426-EP2311807A1
8426-EP2311808A1
8426-EP2311818A1
8426-EP2311826A2
8426-EP2311829A1
8426-EP2311831A1
8426-EP2311840A1
8426-EP2311842A2
8426-EP2314295A1
8426-EP2314576A1
8426-EP2314586A1
8426-EP2316824A1
8426-EP2316831A1
8426-EP2316834A1
Acetic acid, natural, >=99.5%, FG
MolPort-000-871-575
12812-EP2295402A2
12812-EP2316470A2
12812-EP2316831A1
Acetic acid, >=99.5%, FCC, FG
Acetic acid, >=99.7%, for titration in non-aqueous medium
Acetic acid, puriss., 99-100%
SR-01000944354-1
Acetic acid, glacial or acetic acid solution, >80% acid, by mass
Acetic acid, 99.5-100.0%
Acetic acid, semiconductor grade MOS PURANAL(TM) (Honeywell 17926)
Acetic acid, Environmental, 99.0% min. 500ml
4-02-00-00094 (Beilstein Handbook Reference)
Acetic acid, for luminescence, BioUltra, >=99.5% (GC/T)
Acetic acid, glacial, PharmaGrade, USP, JP, Ph Eur, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production.
Acetic acid, USP, 99.5-100.5%
Acetic acid solution, SAJ first grade, 27.0-33.0%
Acetic acid solution, not less than 50% but more than 80% acid, by mass
Acetic acid solution, with more than 10% and less than 50% acid, by mass
Acetic acid, of a concentration of more than 10 per cent, by weight, of acetic acid
Acetic acid, glacial or acetic acid solution, >80% acid, by mass [UN2789] [Corrosive]
InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4
Acetic acid, glacial or acetic acid solution, >80% acid, by mass [UN2789] [Corrosive]
Acetic acid solution, with more than 10% and less than 50% acid, by mass [UN2790] [Corrosive]
ACETIC ACID-1-13C, D4, 99 ATOM % 13C, 98 ATOM % D
Acetic acid solution, not less than 50% but more than 80% acid, by mass [UN2790] [Corrosive]
Acetic acid, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.8%
Acetic acid, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.8%
Acetic acid, puriss., meets analytical specification of Ph. Eur., BP, USP, FCC, 99.8-100.5%
IUPAC nameacetic acid
SMILESCC(=O)O
InchiInChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
FormulaCH3COOH
PubChem ID176
Molweight60.052
LogP-0.22
Atoms8
Bonds7
H-bond Acceptor2
H-bond Donor1
Chemical ClassificationAcids carboxylic acid

mVOC Specific Details

Volatilization
The Henry's Law constant for acetic acid has been experimentally determined to be 1.43X10-7 atm-cu m/mole at 25 deg C(1). This Henry's Law constant indicates that acetic acid is expected to be essentially nonvolatile from water surfaces(2). Acetic acid's Henry's Law constant indicates that volatilization from moist soil surfaces is not expected to be an important fate process(SRC). Acetic acid is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 15.7 mm Hg at 25 deg C(3).
Literature: (1) Johnson BJ et al; J Atmos Chem 24: 113-119 (1996) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng. New York, NY: Hemisphere Pub Corp (1989)
Soil Adsorption
A log Koc of 0.00 (Koc = 1), which was derived from experimental measurements, has been reported for acetic acid(1,2). According to a classification scheme(3), this Koc value suggests that acetic acid is expected to have very high mobility in soil. No detectable sorption was measured for acetic acid using the OECD Guideline 106 method employing an acidic forest soil, pH 2.8, an agricultural soil, pH 6.7, and a lake sediment, pH 7.1(4). Adsorption of acetic acid to 3 nearshore marine sediments collected from three different locations resulted in Kd values of 0.65 (Koc = 228), 0.085 (Koc = 6.5) and 0.046 (Koc = 27) using clastic mud (3.5% organic carbon, pH 7.0), muddy sand (1.3% organic carbon, pH 7.7), and carbonate sand (0.17% organic carbon, pH 8.1), respectively(5). The pKa of acetic acid is 4.76(6), indicating that this compound will exist partially in anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(7).
Literature: (1) Schuurmann G et al; Environ Sci Technol 40: 7005-7011 (Supplemental material) (2006) (2) Meylan WM et al; Environ Sci Technol 26: 1560-7 (1992) (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Von Oepen B et al; Chemosphere 22: 285-304 (1991) (5) Sansone JF et al; Geochimica et Cosmochimica Acta 51: 1889-1896 (1987) (6) Serjeant EP, Dempsey B; Ionisation Constants of Organic Acids in Aqueous Solution. IUPAC Chemical Data Series No. 23. New York, NY: Pergamon Press, p. 989 (1979) (7) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Literature: #In 24 hr aqueous adsorption studies using montmorillonite and kaolinite clay adsorbents, 2.4-30.4% of added acetic acid was observed to be in the adsorbed phase(1). In adsorption studies using the adsorbent hydroxyapatite (a mineral which occurs in the environment as a result of the diagenesis of skeletal apatite), only 5% of added acetic acid (in aqueous solution, pH 8.0) became adsorbed to the hydroxyapatite(2). Acetic acid has been noted to leach from biological disposal areas(3).
Literature: (1) Hemphill L, Swanson WS; Proc of the 18th Industrial Waste Conf, Eng Bull Purdue Univ, Lafayette IN 18: 204-17 (1964) (2) Gordon AS, Millero FJ; Microb Ecol 11: 289-98 (1985) (3) Abrams EF et al; Identification of Organic Compounds in Effluents from Industrial Sources. USEPA-560/3-75-002 p. 3 (1975)
Vapor Pressure
PressureReference
15.7 mm Hg at 25 deg C /Extrapolated/Daubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
MS-MS Spectrum 2640 - LC-ESI-QQ (API3000, Applied Biosystems) 50V Negative
MS-MS Spectrum 2637 - LC-ESI-QQ (API3000, Applied Biosystems) 20V Negative
MS-MS Spectrum 2638 - LC-ESI-QQ (API3000, Applied Biosystems) 30V Negative
MS-MS Spectrum 179743
MS-MS Spectrum 182077
MS-MS Spectrum 182078
MS-MS Spectrum 71 - Quattro_QQQ 40V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 179744
MS-MS Spectrum 70 - Quattro_QQQ 25V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 2636 - LC-ESI-QQ (API3000, Applied Biosystems) 10V Negative
MS-MS Spectrum 179742
MS-MS Spectrum 69 - Quattro_QQQ 10V Positive delivery=Flow_Injection analyzer=Triple_Quad
MS-MS Spectrum 182076
MS-MS Spectrum 2635 - EI-B (HITACHI M-80B) Positive
MS-MS Spectrum 2639 - LC-ESI-QQ (API3000, Applied Biosystems) 40V Negative
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaAcinetobacter Baumaniiclinical exudatesJulak et al. 2003
BacteriaActinobacillus Actinomycetemcomitans Y4n/aKurita-Ochiai et al., 1995
BacteriaActinomyces Europaeusclinical exudatesJulak et al. 2003
BacteriaActinomyces Naeslundiiclinical exudatesJulak et al. 2003
BacteriaArthrobacter Agilis UMCV2narhizosphere of maize plantsVelázquez-Becerra et al.,2011
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Pumilus ES4promotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaBacillus Spp.Highly attractive to Mexican fruit flies.Schulz and Dickschat, 2007
BacteriaBacteroides Biviusn/aWiggins et al., 1985
BacteriaBacteroides Capillosusclinical exudatesJulak et al. 2003
BacteriaBacteroides Distasonisn/aWiggins et al., 1985
BacteriaBacteroides FragilisReduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
BacteriaBacteroides Ovatusn/aWiggins et al., 1985
BacteriaBacteroides Pyogenesclinical exudatesJulak et al. 2003
BacteriaBacteroides Thetaiotamicronn/aWiggins et al., 1985
BacteriaBacteroides Vulgatusn/aWiggins et al., 1985
BacteriaBurkholderia Tropica MTo431n/aTenorio-Salgado et al., 2013
BacteriaCapnocytophaga Ochracea ATCC 33596n/aKurita-Ochiai et al., 1995
BacteriaClostridium Bifermentansn/aWiggins et al., 1985
BacteriaClostridium Butyricumn/aWiggins et al., 1985
BacteriaClostridium Cadaverumn/aWiggins et al., 1985
BacteriaClostridium Difficileclinical exudatesJulak et al. 2003
BacteriaClostridium Fallaxn/aWiggins et al., 1985
BacteriaClostridium Histolyticumn/aWiggins et al., 1985
BacteriaClostridium Perfringensclinical exudatesJulak et al. 2003
BacteriaClostridium Ramosumclinical exudatesJulak et al. 2003
BacteriaClostridium Septicumclinical exudatesJulak et al. 2003
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaClostridium Sporogenesn/aWiggins et al., 1985
BacteriaClostridium Tertiumn/aWiggins et al., 1985
BacteriaEnterococcus Faecalisclinical exudatesJulak et al. 2003
BacteriaEscherichia Colin/aBunge et al., 2008
BacteriaEubacterium Lentumclinical exudatesJulak et al. 2003
BacteriaFusobacterium Necrophorumclinical exudatesJulak et al. 2003
BacteriaFusobacterium Nucleatum ATCC 23726n/aKurita-Ochiai et al., 1995
BacteriaFusobacterium Nucleatum ATCC 33568n/aKurita-Ochiai et al., 1995
BacteriaFusobacterium Simiaeclinical exudatesJulak et al. 2003
BacteriaHaemophilus InfluenzaeclinicPreti., 2009
BacteriaKlebsiella Pneumoniaen/aJulak et al., 2003
BacteriaLactobacillus Acidophilusclinical exudatesJulak et al. 2003
BacteriaLactobacillus Casei NCIB 8010n/aTracey and Britz, 1989
BacteriaLactobacillus Plantarum NCIB 6376n/aTracey and Britz, 1989
BacteriaLactobacillus Rhamnosus CIRM1436naDomiati cheesePogačić et al., 2016
BacteriaLactococcus Lactis DSM 20202n/aTracey and Britz, 1989
BacteriaLeuconostoc Cremoris DSM 20346n/aTracey and Britz, 1989
BacteriaLeuconostoc Dextranicum DSM 20484n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 19n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 30n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 36n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 37Dn/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 7Bn/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos B66n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20252n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20255n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20257n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos Lc5xn/aTracey and Britz, 1989
BacteriaNocardia Sp.clinical exudatesJulak et al. 2003
BacteriaPediococcus Damnosus DSM 20331n/aTracey and Britz, 1989
BacteriaPeptostreptococcus Anaerobicusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Asaccharolyticusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Prevotiiclinical exudatesJulak et al. 2003
BacteriaPorphyromonas Gingivalis FDC381n/aKurita-Ochiai et al., 1995
BacteriaPorphyromonas Gingivalis W83n/aKurita-Ochiai et al., 1995
BacteriaPrevotella Intermedia ATCC 25261n/aKurita-Ochiai et al., 1995
BacteriaPrevotella Loescheii ATCC 15930n/aKurita-Ochiai et al., 1995
BacteriaPropionibacterium Acnesclinical exudatesJulak et al. 2003
BacteriaPropionibacterium Propionicumclinical exudatesJulak et al. 2003
BacteriaProteus Mirabilisclinical exudatesJulak et al. 2003
BacteriaPseudomonas Brassicacearum USB2104reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Simiae AUnarhizosphere of a soybean field in the province of Rajasthan, IndiaVaishnav et al., 2016
BacteriaSalmonella Enterican/aBunge et al., 2008
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaShigella Flexnerin/aBunge et al., 2008
BacteriaStaphylococcus Aureusn/aJulak et al., 2003
BacteriaStaphylococcus Epidermidisclinical exudatesJulak et al. 2003
BacteriaStaphylococcus Sp.Highly attractive to Mexican fruit flies.Schulz and Dickschat, 2007
BacteriaStreptococcus Agalactiaeclinical exudatesJulak et al. 2003
BacteriaStreptococcus Dysgalactiaemilk of cowsHettinga et al 2010
BacteriaStreptococcus PneumoniaeclinicPreti., 2009
BacteriaStreptococcus Pyogenesclinical exudatesJulak et al. 2003
BacteriaStreptococcus Uberismilk of cowsHettinga et al 2010
BacteriaStreptococcus Viridansclinical exudatesJulak et al. 2003
BacteriaVeillonella Spp.Reduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
FungiCandida Albicansclinical exudatesJulak et al. 2003
FungiCandida Tropicalisn/aBunge et al., 2008
FungiMuscodor Albus CZ-620n/aCorcuff et al., 2011
FungiPenicillium Aurantiogriseumn/aBoerjesson et al., 1990
Fungi Penicillium CamembertiLarsen 2000
Fungi Penicillium CaseifulvumLarsen 2000
FungiSaccharomyces Cerevisiaegrape vineBecher et al. 2012
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber Excavatumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaAcinetobacter Baumaniipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaActinobacillus Actinomycetemcomitans Y4n/an/a
BacteriaActinomyces Europaeuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaActinomyces Naeslundiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaArthrobacter Agilis UMCV2LB medium/NA mediumSPME-GC/MSNo
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Pumilus ES4TSASPME-GCno
BacteriaBacillus Spp.n/an/a
BacteriaBacteroides Biviusn/an/a
BacteriaBacteroides Capillosuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Distasonisn/an/a
BacteriaBacteroides Fragilisn/an/a
BacteriaBacteroides Ovatusn/an/a
BacteriaBacteroides Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Thetaiotamicronn/an/a
BacteriaBacteroides Vulgatusn/an/a
BacteriaBurkholderia Tropica MTo431Potato dextrose agarHeadspace trapping/ GC-MS
BacteriaCapnocytophaga Ochracea ATCC 33596n/an/a
BacteriaClostridium Bifermentansn/an/a
BacteriaClostridium Butyricumn/an/a
BacteriaClostridium Cadaverumn/an/a
BacteriaClostridium Difficilepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Fallaxn/an/a
BacteriaClostridium Histolyticumn/an/a
BacteriaClostridium Perfringenspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Ramosumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Septicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Sp.n/an/a
BacteriaClostridium Sporogenesn/an/a
BacteriaClostridium Tertiumn/an/a
BacteriaEnterococcus Faecalispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaEscherichia Colin/an/a
BacteriaEubacterium Lentumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaFusobacterium Necrophorumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaFusobacterium Nucleatum ATCC 23726n/an/a
BacteriaFusobacterium Nucleatum ATCC 33568n/an/a
BacteriaFusobacterium Simiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaHaemophilus InfluenzaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
BacteriaKlebsiella PneumoniaeVF (peptone, NaCl) and VL broth (casein hydrolysate, yeast extract, beef extract, cysteine, glucose, NaCl)HS-SPME/GC-MS
BacteriaLactobacillus Acidophiluspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaLactobacillus Casei NCIB 8010n/an/a
BacteriaLactobacillus Plantarum NCIB 6376n/an/a
BacteriaLactobacillus Rhamnosus CIRM1436curd-based broth mediumGC/MSYes
BacteriaLactococcus Lactis DSM 20202n/an/a
BacteriaLeuconostoc Cremoris DSM 20346n/an/a
BacteriaLeuconostoc Dextranicum DSM 20484n/an/a
BacteriaLeuconostoc Oenos 19n/an/a
BacteriaLeuconostoc Oenos 30n/an/a
BacteriaLeuconostoc Oenos 36n/an/a
BacteriaLeuconostoc Oenos 37Dn/an/a
BacteriaLeuconostoc Oenos 7Bn/an/a
BacteriaLeuconostoc Oenos B66n/an/a
BacteriaLeuconostoc Oenos DSM 20252n/an/a
BacteriaLeuconostoc Oenos DSM 20255n/an/a
BacteriaLeuconostoc Oenos DSM 20257n/an/a
BacteriaLeuconostoc Oenos Lc5xn/an/a
BacteriaNocardia Sp.peptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPediococcus Damnosus DSM 20331n/an/a
BacteriaPeptostreptococcus Anaerobicuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Asaccharolyticuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Prevotiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPorphyromonas Gingivalis FDC381n/an/a
BacteriaPorphyromonas Gingivalis W83n/an/a
BacteriaPrevotella Intermedia ATCC 25261n/an/a
BacteriaPrevotella Loescheii ATCC 15930n/an/a
BacteriaPropionibacterium Acnespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPropionibacterium Propionicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaProteus Mirabilispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPseudomonas Brassicacearum USB2104King's B AgarSPME-GC/MSNo
BacteriaPseudomonas Simiae AUNutrient broth; King's B agarGC/MSNo
BacteriaSalmonella Enterican/an/a
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaShigella Flexnerin/an/a
BacteriaStaphylococcus AureusVF (peptone, NaCl) and VL broth (casein hydrolysate, yeast extract, beef extract, cysteine, glucose, NaCl)HS-SPME/GC-MS
BacteriaStaphylococcus Epidermidispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaStaphylococcus Sp.n/an/a
BacteriaStreptococcus Agalactiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaStreptococcus DysgalactiaeGCMS DSQno
BacteriaStreptococcus PneumoniaeBlood agar/chocolate blood agaHS-SPME/GC-MS no
BacteriaStreptococcus Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaStreptococcus UberisGCMS DSQno
BacteriaStreptococcus Viridanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaVeillonella Spp.n/an/a
FungiCandida Albicanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
FungiCandida Tropicalisn/an/a
FungiMuscodor Albus CZ-620n/aHeadspace sampler/GC-MS
FungiPenicillium Aurantiogriseumn/an/a
Fungi Penicillium Camembertino
Fungi Penicillium Caseifulvumno
FungiSaccharomyces Cerevisiaesynthetic minimal mediumGC-MS, EIyes
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTuber Aestivumn/an/a
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/an/a


3-hydroxybutan-2-one

Mass-Spectra

Compound Details

Synonymous names
acetylmethylcarbinol
Dimethylketol
Acethoin
acetoine
ROWKJAVDOGWPAT-UHFFFAOYSA-N
acetoin
NATURAL ACETOIN
Acetyl methyl carbinol
acetylmethyl-
beta-oxobutane
Methanol, acetylmethyl
3-Hydroxybutanone
b-oxobutane
Acetoin, analytical standard
DL-Acetoin
gamma-Hydroxy-beta-oxobutane
1-Hydroxyethyl methyl ketone
Methanol, acetylmethyl-
1-Hydroxethyl methyl ketone
2-Acetoin
Acetyl Methyl Carbinol, Natural
AC1L18NL
AC1Q1JA8
Acetoin (natural)
KSC490C7N
2,3-Butanolone
3-Hydroxy-2-butanone; Acetylmethylcarbinol
NSC7609
UN2621
2-hydroxy-3-oxobutane
3-hydroxy-2-oxobutane
3-hydroxyl-2-butanone
Acetoin, May exist as crystalline dimer
CTK3J0176
HMDB03243
HSDB 974
2-Hydroxy-3-butanone
3-hydroxy-2-butanone
3-hydroxy-2-butanone, hydroxybutanone
3-hydroxybutan-2-one
LS-164
NSC89727
RP18489
C00466
CCRIS 2918
LTBB004792
2-Butanol-3-one
3-Oxo-2-butanol
AK128843
CHEMBL3561873
DTXSID0024399
NSC 7609
NSC-7609
OR035239
OR108639
OR315616
UN 2621
Acetoin, >=96%, natural
CHEBI:15688
DSSTox_CID_4399
2-butanone, 3-hydroxy
3-hydroxy-butan-2-one
AB1002764
AN-45468
ANW-31250
DSSTox_GSID_24399
KB-32104
NSC-89727
SC-18553
DSSTox_RID_77389
LMFA12000020
MFCD00004521
MFCD00038696
AI3-03314
Butan-2-ol-3-one
DB-003392
RTR-018308
ST24042214
TR-018308
.gamma.-Hydroxy-.beta.-oxobutane
AKOS000121293
AKOS017278202
I09-0138
Q-200581
2-Butanone, 3-hydroxy-
BRN 0385636
FEMA No. 2008
FT-0621797
FT-0695713
Acetoin, natural, >=95%, FG
Tox21_302518
513-86-0
F0001-1338
PROPOXY, 1-METHYL-2-OXO-
(+/-)-Acetoin
Acetoin, >=96%, FCC, FG
Butan-2-one, 3-hydroxy-
MCULE-5374414264
NCGC00256914-01
CAS-513-86-0
EINECS 208-174-1
51555-24-9
52217-02-4
Acetyl methyl carbinol [UN2621] [Flammable liquid]
MolPort-001-785-644
Acetyl methyl carbinol [UN2621] [Flammable liquid]
(+/-)-3-Hydroxybutan-2-one
2-Butanone, 3-hydroxy- (8CI,9CI)
2-Butanone, 3-hydroxy-, (R)-
2-01-00-00870 (Beilstein Handbook Reference)
2-Butanone, 3-hydroxy-, (.+/-.)-
IUPAC name3-hydroxybutan-2-one
SMILESCC(C(=O)C)O
InchiInChI=1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3
FormulaC4H8O2
PubChem ID179
Molweight88.106
LogP-0.14
Atoms14
Bonds13
H-bond Acceptor2
H-bond Donor1
Chemical ClassificationKetones Alcohols Alcohol Ketone

mVOC Specific Details

Volatilization
The Henry's Law constant for acetoin is estimated as 1.0X0-5 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that acetoin is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 2 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 28 days(SRC). Acetoin's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Acetoin is expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 2.7 mm Hg(SRC), determined from a fragment constant method(3).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Lyman WJ; p. 31 in Environmental Exposure From Chemicals Vol I, Neely WB, Blau GE, eds, Boca Raton, FL: CRC Press (1985)
Soil Adsorption
The Koc of acetoin is estimated as 2(SRC), using a water solubility of 1.0X10+6 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that aetoin is expected to have very high mobility in soil.
Literature: (1) Yalkowsky SH, Dannenfelser RM; The AQUASOL DATABASE of Aqueous Solubility. Ver 5. Tucson, AZ: Univ AZ, College of Pharmacy (1992) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-5 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
2.7X10+0 at 25 deg C /Estimated/US EPA; Estimation Program Interface (EPI) Suite. Ver.3.11. June 10, 2003. Available from, as of Mar 15, 2005: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaBacillus Amyloliquefaciens IN937atriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al., 2004
BacteriaBacillus Subtilis 168triggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al., 2004
BacteriaBacillus Subtilis GB03triggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al., 2004
BacteriaEscherichia Coli O157:H8China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2017
BacteriaLactobacillus Rhamnosus LSL 216nanaPogačić et al., 2016
BacteriaListeria Monocytogenes ATCC 19111China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaPaenibacillus Polymyxa Sb3-1collection TU GrazRybakova et al. 2017
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaShigella Flexneri CGCMCC 1.1868China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaStaphylococcus Aureusn/aPreti et. al., 2009
BacteriaStaphylococcus Aureus ATCC 6538China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
BacteriaStaphylococcus Sciurinafrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al., 2011
FungiLaccaria Bicolorn/aMueller et al., 2013
FungiPaxillus Involutus MAJn/aMueller et al., 2013
FungiPaxillus Involutus NAUn/aMueller et al., 2013
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiStropharia Rugosoannulatan/aMueller et al., 2013
FungiTrichoderma Viriden/aMueller et al., 2013
FungiTuber BorchiinanaSplivallo and Ebeler 2015
FungiTuber IndicumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaBacillus Cereus B-569n/aBlom et al., 2011
BacteriaBurkholderia Graminis LMG 18924n/aBlom et al., 2011
BacteriaBurkholderia Tropica LMG 22274n/aBlom et al., 2011
BacteriaChromobacterium Violaceum CV0n/aBlom et al., 2011
BacteriaEnterobacter AgglomeransRobacker and Lauzon 2002
BacteriaLimnobacter Thiooxidans LMG 19593n/aBlom et al., 2011
BacteriaPandoraea Norimbergensis LMG 18379n/aBlom et al., 2011
BacteriaPseudomonas Chlororaphisn/aBlom et al., 2011
BacteriaSerratia Entomophilia A1MO2n/aBlom et al., 2011
BacteriaSerratia Marcescens MG1n/aBlom et al., 2011
BacteriaSerratia Plymuthica HRO-C48n/aBlom et al., 2011
BacteriaSerratia Plymuthica IC14n/aBlom et al., 2011
BacteriaSerratia Proteamaculans B5an/aBlom et al., 2011
BacteriaStenotrophomonas Rhizophilla Ep10-p69n/aBlom et al., 2011
FungiCandida Shehataecacti, fruits, insects, natural habitatsNout and Bartelt 1998
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Amyloliquefaciens IN937aInduce growth promotion (leaf surface area), systemic resistance (ISR) and regulate auxin homeostasis in Arabidopsis thaliana.Ryu et al., 2003
BacteriaBacillus Amyloliquefaciens UCMB5113nanaAsari et al., 2016
BacteriaBacillus Pumilus ES4promotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaBacillus Spp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
BacteriaBacillus Subtilis GB03Induce growth promotion (leaf surface area), systemic resistance (ISR) and regulate auxin homeostasis in Arabidopsis thaliana.Ryu et al., 2003
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaCoagulase-negative Staphylococcin/aHettinga et al., 2008
BacteriaEnterobacter Spp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
BacteriaEscherichia Coli DH5apromotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaKlebsiella Sp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
BacteriaLactobacillus Casei NCIB 8010n/aTracey and Britz, 1989
BacteriaLactobacillus Plantarum NCIB 6376n/aTracey and Britz, 1989
BacteriaLactococcus Lactis DSM 20202n/aTracey and Britz, 1989
BacteriaLeuconostoc Cremoris DSM 20346n/aTracey and Britz, 1989
BacteriaLeuconostoc Dextranicum DSM 20484n/aTracey and Britz, 1989
BacteriaLeuconostoc Mesenteroides DSM 20343n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos B66n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 19n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 30n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 36n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 37Dn/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20255n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20257n/aTracey and Britz, 1989
BacteriaLeuconostoc Paramesenteroides DSM 20288n/aTracey and Britz, 1989
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaPediococcus Damnosus DSM 20331n/aTracey and Britz, 1989
BacteriaSerratia Sp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
BacteriaStaphylococcus Aureusn/aHettinga et al., 2008
BacteriaStaphylococcus Epidermidis DSM 3269clinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Haemolyticus CCM 2729clinical isolate,human skinLemfack et al. 2016
BacteriaStaphylococcus Saccharolyticus B5709clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi DSMZ 4807clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi H34clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
BacteriaStaphylococcus Warneri CCM 2730clinical isolate,human skinLemfack et al. 2016
BacteriaStreptococcus Dysgalactiaemilk of cowsHettinga et al 2010
BacteriaStreptococcus Uberisn/aHettinga et al., 2008
BacteriaStreptomyces Spp.It is an attractant to Anastrepha ludens (Diptera).Schulz and Dickschat, 2007
Fungi Dickschat et al. 2011
FungiBoletus Variegatusn/aStotzky and Schenk, 1976
FungiSaccharomyces Cerevisiaegrape vineBecher et al. 2012
FungiTrichoderma Viriden/aHung et al., 2013
FungiVerticillium Longisporumcollection TU GrazRybakova et al. 2017
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaCollimonas Fungivorans Ter331sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCollimonas Pratensis Ter91sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaBacillus Amyloliquefaciens IN937aMurashige and Skoog mediumcapillary GC;GC/MSYes
BacteriaBacillus Subtilis 168Murashige and Skoog mediumcapillary GC;GC/MSYes
BacteriaBacillus Subtilis GB03Murashige and Skoog mediumcapillary GC;GC/MSYes
BacteriaEscherichia Coli O157:H8Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaLactobacillus Rhamnosus LSL 216curd-based broth mediumGC/MSYes
BacteriaListeria Monocytogenes ATCC 19111Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaPaenibacillus Polymyxa Sb3-1GC-MS / SPMEno
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaShigella Flexneri CGCMCC 1.1868Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaStaphylococcus AureusBlood agar/chocolate blood agaHS-SPME/GC-MS
BacteriaStaphylococcus Aureus ATCC 6538Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
BacteriaStaphylococcus Sciuri867 liquid mediumSPME-GC/MS
FungiLaccaria BicolorMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPaxillus Involutus MAJMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPaxillus Involutus NAUMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiStropharia RugosoannulataMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiTrichoderma VirideMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiTuber BorchiinaSPME-GC/MS/O); GC-RYes
FungiTuber IndicumYes
FungiTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
BacteriaBacillus Cereus B-569MR-VP and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Graminis LMG 18924MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Tropica LMG 22274MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaChromobacterium Violaceum CV0MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaEnterobacter Agglomeransno
BacteriaLimnobacter Thiooxidans LMG 19593 MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPandoraea Norimbergensis LMG 18379MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Chlororaphis MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Entomophilia A1MO2 MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Marcescens MG1LB, MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Plymuthica HRO-C48MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Plymuthica IC14MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Proteamaculans B5aLB, MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaStenotrophomonas Rhizophilla Ep10-p69 MR-VP and LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
FungiCandida Shehataeyeast malt agarSPME, GC-MSyes
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Amyloliquefaciens IN937an/an/a
BacteriaBacillus Amyloliquefaciens UCMB5113M9AGC/MSNo
BacteriaBacillus Pumilus ES4TSASPME-GCno
BacteriaBacillus Spp.n/an/a
BacteriaBacillus Subtilis GB03n/an/a
BacteriaClostridium Sp.n/an/a
BacteriaCoagulase-negative StaphylococciMilkHS-SPME/GC-MS
BacteriaEnterobacter Spp.n/an/a
BacteriaEscherichia Coli DH5aTSASPME-GCno
BacteriaKlebsiella Sp.n/an/a
BacteriaLactobacillus Casei NCIB 8010n/an/a
BacteriaLactobacillus Plantarum NCIB 6376n/an/a
BacteriaLactococcus Lactis DSM 20202n/an/a
BacteriaLeuconostoc Cremoris DSM 20346n/an/a
BacteriaLeuconostoc Dextranicum DSM 20484n/an/a
BacteriaLeuconostoc Mesenteroides DSM 20343n/an/a
BacteriaLeuconostoc Oenos B66n/an/a
BacteriaLeuconostoc Oenos 19n/an/a
BacteriaLeuconostoc Oenos 30n/an/a
BacteriaLeuconostoc Oenos 36n/an/a
BacteriaLeuconostoc Oenos 37Dn/an/a
BacteriaLeuconostoc Oenos DSM 20255n/an/a
BacteriaLeuconostoc Oenos DSM 20257n/an/a
BacteriaLeuconostoc Paramesenteroides DSM 20288n/an/a
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaPediococcus Damnosus DSM 20331n/an/a
BacteriaSerratia Sp.n/an/a
BacteriaStaphylococcus AureusMilkHS-SPME/GC-MS
BacteriaStaphylococcus Epidermidis DSM 3269brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Haemolyticus CCM 2729brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Saccharolyticus B5709brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi DSMZ 4807brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi H34brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sp.n/an/a
BacteriaStaphylococcus Warneri CCM 2730brain heart infusion mediumPorapak / GC/MSno
BacteriaStreptococcus DysgalactiaeGCMS DSQno
BacteriaStreptococcus UberisMilkHS-SPME/GC-MS
BacteriaStreptomyces Spp.n/an/a
Fungi no
FungiBoletus Variegatusn/an/a
FungiSaccharomyces Cerevisiaesynthetic minimal mediumGC-MS, EIyes
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MS
FungiVerticillium Longisporumpotato dextrose agar (PDA), Czapek Dox liquid cultureGC-MS / SPMEno


Propan-2-one

Mass-Spectra

Compound Details

Synonymous names
Dimethylformaldehyde
dimethylcetone
dimethylketone
Dimethyl formaldehyde
Dimethylketal
Dimethylketon
methylketone
isopropanal
CSCPPACGZOOCGX-UHFFFAOYSA-N
Propanon
propanone
Sasetone
Aceton
acetone
Acetone, Spectrophotometric Grade
Azeton
beta-Ketopropane
Chevron acetone
Citronellidene Acetone; Baccartol
Dimethyl ketone
Pyroacetic acid
Pyroacetic ether
2propanone
b-Ketopropane
Dimethylketone, Pyroacetic acid
Ketone propane
Methyl ketone
methyl-ketone
Acetone HP
Acetone HPLC grade
Acetone, analytical standard
Acetone, Environmental Grade
Acetone, Semiconductor Grade
d-acetone
Acetone Reagent Grade ACS
Ketone, dimethyl
2-propanal
2-propanone
Acetone, technical grade
ACETONE, ACS
ACETONE, HPLC
AC1L18NO
Acetone, ACS reagent
Acetone, HPLC Grade
Acetone, suitable for determination of dioxins
.beta.-Ketopropane
Acetone (natural)
Acetone, for HPLC
ACMC-1AI6Y
Ketone, dimethyl-
Pyroacetic spirit (archaic)
Acetone, pharmaceutical secondary standard; traceable to USP
Acetone, puriss.
HSDB 41
KSC353M9B
propan-2-one
UNII-N4G9GAT76C component CSCPPACGZOOCGX-UHFFFAOYSA-N
CHEMBL14253
UN1090
A0054
Acetone (NF)
Acetone (TN)
Acetone [NF]
Acetone p.A.
c0556
CTK2F3690
HMDB01659
RL04583
(CH3)2CO
1364PS73AF
C00207
CCRIS 5953
D02311
RCRA waste number U002
WLN: 1V1
ZINC895111
Aceton (GERMAN, POLISH)
Acetone, >=99%, meets FCC analytical specifications
Acetone, GC, for residue analysis
Acetone, United States Pharmacopeia (USP) Reference Standard
DTXSID8021482
LS-1566
NSC135802
OR034251
OR325696
UN 1090
Acetone oil (Salt/Mix)
Acetone, natural, >=97%
CHEBI:15347
DSSTox_CID_1482
UNII-1364PS73AF
AN-41894
DSSTox_GSID_21482
KB-47075
Acetone, 99.5%
Acetone, LR, >=99%
Caswell No. 004
DSSTox_RID_76176
LMFA12000057
MFCD00008765
ZINC00895111
AI3-01238
NSC 135802
NSC-135802
RTR-022713
TR-022713
Acetone, ACS spectrophotometric grade, >=99.5%
AKOS000120890
EPA Pesticide Chemical Code 004101
RCRA waste no. U002
Aceton [German, Dutch, Polish]
Acetone, for chromatography, >=99.8%
Acetone, histological grade, >=99.5%
Acetone, Laboratory Reagent, >=99.5%
FEMA No. 3326
FT-0621799
FT-0671108
67-64-1
Acetone, 99% 1L
I14-51516
Tox21_111096
Tox21_202480
Acetone, >=99.5%, ACS reagent
Acetone, >=99.5%, for residue analysis
Acetone, ACS reagent, >=99.5%
Acetone, AR, >=99.5%
Acetone, for residue analysis, >=99.5%
Acetone, UV HPLC spectroscopic, 99.8%
CAS-67-64-1
2-Propanone, >60% in a non hazardous diluent
4468-52-4
Acetone, for HPLC, >=99.8%
Acetone, for HPLC, >=99.9%
Acetone, JIS special grade, >=99.5%
NCGC00091179-01
NCGC00260029-01
Acetone, puriss., 99.0%
Acetone, SAJ first grade, >=99.0%
EINECS 200-662-2
Acetone [UN1090] [Flammable liquid]
UN 1091 (Salt/Mix)
EC 200-662-2
2941-EP1441224A2
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2941-EP2305627A1
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2941-EP2305636A1
2941-EP2305640A2
2941-EP2305642A2
2941-EP2305648A1
2941-EP2305649A1
2941-EP2305650A1
2941-EP2305651A1
2941-EP2305655A2
2941-EP2305658A1
2941-EP2305660A1
2941-EP2305663A1
2941-EP2305664A1
2941-EP2305665A1
2941-EP2305667A2
2941-EP2305671A1
2941-EP2305672A1
2941-EP2305675A1
2941-EP2305676A1
2941-EP2305677A1
2941-EP2305680A2
2941-EP2305681A1
2941-EP2305682A1
2941-EP2305684A1
2941-EP2305685A1
2941-EP2305686A1
2941-EP2305688A1
2941-EP2305689A1
2941-EP2305695A2
2941-EP2305696A2
2941-EP2305697A2
2941-EP2305698A2
2941-EP2305769A2
2941-EP2305825A1
2941-EP2308471A1
2941-EP2308492A1
2941-EP2308510A1
2941-EP2308562A2
2941-EP2308812A2
2941-EP2308828A2
2941-EP2308838A1
2941-EP2308839A1
2941-EP2308840A1
2941-EP2308841A2
2941-EP2308842A1
2941-EP2308848A1
2941-EP2308849A1
2941-EP2308850A1
2941-EP2308851A1
2941-EP2308853A1
2941-EP2308854A1
2941-EP2308857A1
2941-EP2308858A1
2941-EP2308861A1
2941-EP2308862A1
2941-EP2308864A1
2941-EP2308867A2
2941-EP2308870A2
2941-EP2308872A1
2941-EP2308874A1
2941-EP2308875A1
2941-EP2308876A1
2941-EP2308879A1
2941-EP2308882A1
2941-EP2308926A1
2941-EP2308960A1
2941-EP2309564A1
2941-EP2309584A1
2941-EP2311451A1
2941-EP2311453A1
2941-EP2311455A1
2941-EP2311801A1
2941-EP2311802A1
2941-EP2311803A1
2941-EP2311805A1
2941-EP2311806A2
2941-EP2311808A1
2941-EP2311809A1
2941-EP2311810A1
2941-EP2311811A1
2941-EP2311812A1
2941-EP2311813A1
2941-EP2311814A1
2941-EP2311815A1
2941-EP2311816A1
2941-EP2311817A1
2941-EP2311820A1
2941-EP2311821A1
2941-EP2311822A1
2941-EP2311823A1
2941-EP2311824A1
2941-EP2311825A1
2941-EP2311826A2
2941-EP2311828A1
2941-EP2311829A1
2941-EP2311830A1
2941-EP2311832A1
2941-EP2311833A1
2941-EP2311837A1
2941-EP2311838A1
2941-EP2311841A1
2941-EP2311842A2
2941-EP2314298A1
2941-EP2314558A1
2941-EP2314571A2
2941-EP2314576A1
2941-EP2314577A1
2941-EP2314581A1
2941-EP2314583A1
2941-EP2314584A1
2941-EP2314585A1
2941-EP2314587A1
2941-EP2314590A1
2941-EP2314591A1
2941-EP2314593A1
2941-EP2315303A1
2941-EP2315502A1
2941-EP2316450A1
2941-EP2316452A1
2941-EP2316824A1
2941-EP2316826A1
2941-EP2316829A1
2941-EP2316831A1
2941-EP2316832A1
2941-EP2316833A1
2941-EP2316836A1
2941-EP2316905A1
2941-EP2316906A2
2941-EP2370388A1
2941-EP2370389A1
2941-EP2371803A1
2941-EP2371805A1
2941-EP2371808A1
2941-EP2371811A2
2941-EP2371814A1
2941-EP2371831A1
2941-EP2372017A1
2941-EP2373607A1
2941-EP2374454A1
2941-EP2374533A1
2941-EP2374538A1
2941-EP2374790A1
2941-EP2374895A1
2941-EP2377842A1
2941-EP2377843A1
2941-EP2377845A1
2941-EP2377847A1
2941-EP2380568A1
2941-EP2380873A1
2941-EP2380874A2
2973-EP2272827A1
2973-EP2272846A1
2973-EP2275422A1
2973-EP2277868A1
2973-EP2277869A1
2973-EP2277870A1
2973-EP2280000A1
2973-EP2284166A1
2973-EP2287164A1
2973-EP2289483A1
2973-EP2289881A1
2973-EP2292608A1
2973-EP2292616A1
2973-EP2295436A1
2973-EP2298076A1
2973-EP2298077A1
2973-EP2298749A1
2973-EP2298769A1
2973-EP2301353A1
2973-EP2305031A1
2973-EP2305033A1
2973-EP2305034A1
2973-EP2305035A1
2973-EP2305665A1
2973-EP2305682A1
2973-EP2308492A1
2973-EP2308866A1
2973-EP2308878A2
2973-EP2314580A1
2973-EP2371805A1
2973-EP2374791A1
6121-EP0930075A1
Acetone, for residue analysis, suitable for 5000 per JIS
MolPort-000-871-974
Acetone [UN1090] [Flammable liquid]
79278-EP2305695A2
79278-EP2305696A2
79278-EP2305697A2
79278-EP2305698A2
81217-EP2298761A1
81217-EP2301544A1
81217-EP2305254A1
81217-EP2305687A1
88746-EP2275105A1
88746-EP2305825A1
Acetone, for luminescence, >=99.5% (GC)
Acetone, purum, >=99.0% (GC)
Acetone, ReagentPlus(R), phenol free, >=99.5%
Acetone, semiconductor grade MOS PURANAL(TM) (Honeywell 17921)
Acetone, semiconductor grade ULSI PURANAL(TM) (Honeywell 17014)
Acetone, semiconductor grade VLSI PURANAL(TM) (Honeywell 17617)
Acetone, for HPLC, >=99.8% (GC)
2-Propanone, >10 - 60% in a non hazardous diluent
Acetone, for UV-spectroscopy, ACS reagent, >=99.7% (GC)
Acetone solution, contains 20.0 % (v/v) acetonitrile, for HPLC
InChI=1/C3H6O/c1-3(2)4/h1-2H
Acetone, HPLC Plus, for HPLC, GC, and residue analysis, >=99.9%
Acetone solution, certified reference material, 2000 mug/mL in methanol: water (9:1)
Acetone, puriss., meets analytical specification of Ph. Eur., BP, NF, >=99% (GC)
Acetone, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.5% (GC)
IUPAC namepropan-2-one
SMILESCC(=O)C
InchiInChI=1S/C3H6O/c1-3(2)4/h1-2H3
FormulaCH3COCH3
PubChem ID180
Molweight58.08
LogP0.11
Atoms10
Bonds9
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationKetones

mVOC Specific Details

Volatilization
The Henry's Law constant for acetone was measured as 3.50X10-5 atm-cu m/mole(SRC) at 25 deg C(1). This value indicates that acetone is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as approximately 21 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as approximately 8.8 days(SRC). Volatilization rate constants of acetone measured in an experimental stream (234 m long, water velocity 0.67 m/min) were in the range of 8.23X10-4 min-1 to 11.1X10-4 min-1(3); these rate constants correspond to volatilization half-lives of about 10-14 hours(3). Similar experiments in the same stream measured acetone volatilization rate constants in the range of 6.22X10-4 min-1 to 14.5X10-4 min-1(4,5); these rate constants correspond to volatilization half-lives of about 8-18 hours(4,5). Acetone is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 231 mm Hg at 25 deg C(6).
Literature: (1) Benkelberg HJ et al; J Atmos Chem 20: 17-34 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Rathbun RE et al; J Hydrol 104: 181-209 (1988) (4) Rathbun RE et al; J Hydrol 123: 225-42 (1991) (5) Rathbun RE et al; Environ Pollut 79: 153-62 (1993) (6) Alarie Y et al; Toxicol Appl Pharmacol 134: 92-99 (1995)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of acetone can be estimated to be 2.4(SRC). According to a classification scheme(2), this estimated Koc value suggests that acetone is expected to have very high mobility in soil. In sorption studies, acetone showed no adsorption to montorillonite, kaolinite clay, or stream sediment(3,4).
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.11. Nov, 2012. Available from, as of Feb 10, 2015: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Swann RL et al; Res Rev 85: 23 (1983) (3) Rathbun RE et al; Chemosphere 11: 1097-114 (1982) (4) Wolfe TA et al; J Water Pollut Control Fed 58: 68-76 (1986)
Vapor Pressure
PressureReference
231 mm Hg at 25 deg CAlarie Y et al; Toxicol Appl Pharmacol 134: 92-99 (1995)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBacillus Megaterium USB2103lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiPhomopsis Sp.naendophyte of Odontoglossum sp.Singh et al., 2011
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTrichodema Pseudokoningiin/aWheatley et al., 1997
FungiTrichodema Viriden/aWheatley et al., 1997
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaEscherichia Colin/aBunge et al., 2008
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaRalstonia SolanacearumnanaSpraker et al., 2014
BacteriaSaccharomonospora Rectivirgula DSM 43113nasoil Wilkins, 1996
BacteriaShigella Flexnerin/aBunge et al., 2008
BacteriaStreptomyces Diastatochromogenes ETH 18822n/aSchoeller et al., 2002
BacteriaStreptomyces Albidoflavus AMI 246n/aSchoeller et al., 2002
BacteriaStreptomyces Albus IFO 13014n/aSchoeller et al., 2002
BacteriaStreptomyces Albus Subsp. Pathocidicus IFO 13812n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticus CBS 659.68n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticus ETH 22014n/aSchoeller et al., 2002
BacteriaStreptomyces Aureofaciens ETH 28832n/aSchoeller et al., 2002
BacteriaStreptomyces Coelicolor DSM 40233n/aSchoeller et al., 2002
BacteriaStreptomyces Diastatochromogenes ETH 18822n/aSchoeller et al., 2002
BacteriaStreptomyces Diastatochromogenes IFO 13814n/aSchoeller et al., 2002
BacteriaStreptomyces Griseus ATCC 23345n/aSchoeller et al., 2002
BacteriaStreptomyces Griseus IFO 13849n/aSchoeller et al., 2002
BacteriaStreptomyces Hirsutus ATCC 19773n/aSchoeller et al., 2002
BacteriaStreptomyces Hirsutus ETH 1666n/aSchoeller et al., 2002
BacteriaStreptomyces Hygroscopicus ATCC 27438n/aSchoeller et al., 2002
BacteriaStreptomyces Hygroscopicus IFO 13255n/aSchoeller et al., 2002
BacteriaStreptomyces Murinus DSM 40091n/aSchoeller et al., 2002
BacteriaStreptomyces Murinus NRRL 8171n/aSchoeller et al., 2002
BacteriaStreptomyces Olivaceus ETH 6445n/aSchoeller et al., 2002
BacteriaStreptomyces Olivaceus ETH 7437n/aSchoeller et al., 2002
BacteriaStreptomyces Rishiriensis AMI 224n/aSchoeller et al., 2002
BacteriaStreptomyces Spp. AMI 240n/aSchoeller et al., 2002
BacteriaStreptomyces Spp. AMI 243n/aSchoeller et al., 2002
BacteriaStreptomyces Thermoviolaceus CBS 111.62n/aSchoeller et al., 2002
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
FungiCandida Tropicalisn/aBunge et al., 2008
FungiCeratocystis Sp.Inhibited growth of fungi. Has no effect on bacteria.Stotzky and Schenk, 1976
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPhialophora Fastigiata ConantnanaSunesson et al., 1995
FungiThielaviopsis BasicolaInhibited growth of fungi. Has no effect on bacteria.Stotzky and Schenk, 1976
FungiTrichoderma Sp.Inhibited growth of fungi. Has no effect on bacteria.Stotzky and Schenk, 1976
FungiTrichoderma VirideHung et al., 2013
FungiTuber SimoneaNoneNone March et al., 2006
FungiTuber Aestivumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Simonean/aAyme Truffe of Grignan, 26230 France March et al., 2006
Fungi Penicillium CamembertiLarsen 2002
Fungi Penicillium CaseifulvumLarsen 2002
BacteriaBacillus Simplexn/aGu et al., 2007
BacteriaBacillus Subtilisn/aGu et al., 2007
BacteriaBacillus Weihenstephanensisn/aGu et al., 2007
BacteriaMicrobacterium Oxydansn/aGu et al., 2007
BacteriaSerratia Marcescensn/aGu et al., 2007
BacteriaStaphylococcus Sciurinafrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al., 2011
BacteriaStenotrophomonas Maltophilian/aGu et al., 2007
BacteriaStreptomyces Lateritiusn/aGu et al., 2007
FungiTuber Aestivumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Oligospermumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBacillus Megaterium USB2103King's B AgarSPME-GC/MSNo
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
FungiPhomopsis Sp.PDA mediumSPME-GC/MSYes
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTrichodema PseudokoningiiMalt extract/Low mediumGC/MS
FungiTrichodema VirideMalt extract/Low mediumGC/MS
FungiTuber Aestivumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
FungiTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaEscherichia Colin/an/a
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaRalstonia SolanacearumCasamino Acid Peptone Glucose agarSPME-GC/MSNo
BacteriaSaccharomonospora Rectivirgula DSM 43113Nutrient agar CM3GC/MS
BacteriaShigella Flexnerin/an/a
BacteriaStreptomyces Diastatochromogenes ETH 18822Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Albidoflavus AMI 246n/an/a
BacteriaStreptomyces Albus IFO 13014n/an/a
BacteriaStreptomyces Albus Subsp. Pathocidicus IFO 13812n/an/a
BacteriaStreptomyces Antibioticus CBS 659.68n/an/a
BacteriaStreptomyces Antibioticus ETH 22014n/an/a
BacteriaStreptomyces Aureofaciens ETH 28832n/an/a
BacteriaStreptomyces Coelicolor DSM 40233n/an/a
BacteriaStreptomyces Diastatochromogenes ETH 18822n/an/a
BacteriaStreptomyces Diastatochromogenes IFO 13814n/an/a
BacteriaStreptomyces Griseus ATCC 23345n/an/a
BacteriaStreptomyces Griseus IFO 13849n/an/a
BacteriaStreptomyces Hirsutus ATCC 19773n/an/a
BacteriaStreptomyces Hirsutus ETH 1666n/an/a
BacteriaStreptomyces Hygroscopicus ATCC 27438n/an/a
BacteriaStreptomyces Hygroscopicus IFO 13255n/an/a
BacteriaStreptomyces Murinus DSM 40091n/an/a
BacteriaStreptomyces Murinus NRRL 8171n/an/a
BacteriaStreptomyces Olivaceus ETH 6445n/an/a
BacteriaStreptomyces Olivaceus ETH 7437n/an/a
BacteriaStreptomyces Rishiriensis AMI 224n/an/a
BacteriaStreptomyces Spp. AMI 240n/an/a
BacteriaStreptomyces Spp. AMI 243n/an/a
BacteriaStreptomyces Thermoviolaceus CBS 111.62n/an/a
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
FungiCandida Tropicalisn/an/a
FungiCeratocystis Sp.n/an/a
FungiPenicillium Commune PittDG18GC/MS
FungiPhialophora Fastigiata ConantDG18GC/MS
FungiThielaviopsis Basicolan/an/a
FungiTrichoderma Sp.n/an/a
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSYes
FungiTuber SimoneaNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MS
Fungi Penicillium Camembertino
Fungi Penicillium Caseifulvumno
BacteriaBacillus Simplexn/an/a
BacteriaBacillus Subtilisn/an/a
BacteriaBacillus Weihenstephanensisn/an/a
BacteriaMicrobacterium Oxydansn/an/a
BacteriaSerratia Marcescensn/an/a
BacteriaStaphylococcus Sciuri863 liquid mediumSPME-GC/MS
BacteriaStenotrophomonas Maltophilian/an/a
BacteriaStreptomyces Lateritiusn/an/a
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Oligospermumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


Compound Details

Synonymous names
Altitudemedical Hand Antibacterial
Antibacterial Sanitizer
Careone Antibacterial Sanitizer Limoncello
Germstarcitrus
Methylcarbinol
Aethylalkohol
Antibacterial Hand Gingerbread
Antibacterial Hand Sanitizer Sunblossom
Boolicious Antibacterial Hand Sanitizer
Careone Antibacterial Sanitizer Gingerbread House
Careone Antibacterial Sanitizer Peppermint Candy
Ethylalcohol
Germstarnoro
Germstarnoro Unscented
Hand Sanitizer Passionfruit Pomegranate
Humphreys Alcoholado Maravilla
Hydroxyethane
Industrial Antiseptic Sanitizer
Jurlique Moisturizing Hand Sanitizer Natural Antibacterial
Marshmallow Antibacterial Hand
Pretty Peppermint Antibacterial
Sekundasprit
Strawberry Antibacterial Hand Sanitizer
Actiprep Preoperative Skin Preparation
Antibacterial Hand Sanitizer
Antibacterial Hand Sanitizer Pamegranate Apple
Antibacterial Hand Towelettes
Antibactierial Hand Sanitizer
Antimicrobial Hand Sanitizer
Aprilguard Antiseptic Handrub
Boolicious Antibacterial Hand
Cucumber Melon Antibacterial Sanitizer
Dial Professional Antibacterial Hand Sanitizer
Ethanolum anhydricum
Fermentation alcohol
Gingerbread
Hamamelis virginiana
Hinetoless
Holiday Cookie Antibacterial
Instafresh
Lalaloopsy Watermelon Antiseptic Hand Cleansing
Lavender Antibacterial Hand Sanitizer
Mandarin Antibacterial Hand Sanitizer
Marshmallow
Methylated Spirit Mineralised
Oxydimethylene Group
Raspberry Guava Antibacterial
Safesha Unfragranced
Spatheraphy
Spatherapy Grapefruit Nectar
Spatherapy Lemon Pomegranate
Triseptin Waterless
undenatured Ethanol
Advanced
Aethanol
Alcohol anhydrous
Alcohol dehydrated
Alcohols
Alkoholu etylowego
Almond Antibacterial Hand Sanitizer
Anhydrol
Anhydrous alcohol
Anhydrous ethanol
Antiacterial Hand Sanitizer
Blackberry Vanilla Hand Sanitizer Bodycology
Body Luxuries Strawberry Shortcake Antibacterial Hand Sanitizer
Bodycology Moisturizing Hand Sanitizer Cherry Blossom
Bodycology Moisturizing Hand Sanitizer Cucumber Melon
Bodycology Moisturizing Hand Sanitizer Midnight Garden
Bodycology Vanilla Cupcake
Careone Antibacterial Hand Sanitizer Mistletoe Kisses
Careone Antibacterial Hand Sanitizer Seasons Greetings
Clorox Antimicrobial Hand Sanitizer
Coconut Antibacterial Hand Sanitizer
Coconut Lime Antibacterial Sanitizer
Colemanhand Sanitizer Hand Sanitizer
Cranberry Vanilla Scented Antibacterial Hand Sanitizer
Decolorized Iodine
Dehydrated alcohol
Dehydrated ethanol
Denatured alcohol
Denatured ethanol
Distilled spirits
Egyptian Cotton Antibacterial Hand Sanitizer
Ethanol Anhydrous
Ethanol vergaellt
Foamahol
Hand Sanitizing Strawberry
Handful Sanitizer
Hanitizer
HYDROXYETHYL GROUP
Infectiguard Hand Sanitizer
Justice Watermelon Scent Antibacterial Hand Sanitizer
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Lollipop
Medisoft
Methylated spirit
Microban
Microban Unscented
Moisturizing Hand Sanitizer
Moisturizing Instant Hand Sanitizer
Naturals Vanilla Antibacterial Hand
Peppermint Swirl Antibacterial Hand Sanitizer
Pineapple Paradise
Pink Grapefruit Antibacterial Hand Sanitizer
POLYETHYLENGLYCOL11
Proandre
Purell Advanced Refreshing
Purell Alcohol Formulation
Sanifoam
Sanitaxe
Sanitizer
Satsuma Antibacterial Hand Sanitizer
Shopko Antibacterial Hand Sanitizer
Smartcare Shopkins
Spatherapy Eucalyptus Mint
Spatherapy Lavender Jasmine
Spatherapy Raspberry Brulee
Sterillium Comfort
Strawberry Champagne Hand Sanitizer
Swirling Lollipop
Twisted Peppermint
Unscented
Vanilla Cupcake Antibacterial Hand Sanitizer
Very Vanilla Antibacterial
Xtracare Lavender Chamomile
Zylast Antiseptic
absolute alcohol
Absolute ethanol
Aftermath Hand Sanitizer
alcohol
alcohol etilico
Alcool ethylique
Algrain
Alkohol
Antibacterial Hand Cranberry Spice
Antibacterial Hand Sanitizer Citrus Coconut
Antibacterial Hand Sanitizer Passion Flower
Antibacterial Hand Sanitizer Pocket Sprayer
Antibacterial Hand Sanitizer Spray
Antiseptic Hand Sanitizer
Assured Instant
Aurora Antibacterial Sanitizer Summer Cotton Breeze
Beautos Antibacterial Hand Sanitizer Lemon
Bodycology Moisturizing Hand Sanitizer Sweet Petals
Bodycology Moisturizing Hand Sanitzer White Gardenia
Branders Antiseptic Hand Sanitizer
Cardinal Health Sanitizer
Careone
Careone Antibacterial Sanitizer Fresh Water
Celox Antiseptic
Charlie Girl Blueberry Antibacterial Hand Sanitizer
Charlie Girl Strawberry Antibacterial Hand Sanitizer
Claires
Claires Fancy Nancy Antibacterial Strawberry Parfait
Claree
Clinishield Instant Hand Sanitizer
Coconut Tuberose
Cologne spirits
Cranberry Hand Sanitizer
Creamsicle Hand Sanitizer
Cupcake
Daisy Blossom Antibacterial Hand Sanitizer
Deb Instantfoam Alcohol Sanitizer
Deb Instantfoam Complete
Dermagel Hand Sanitizing
Digisan
Digisan Healthcare Hand Sanitizer
diluted Alcohol
Drinking alcohol
Elyptol Antimicrobial Rub
Enchanted Forest Hand Sanitizer Bodycology
Envirokleen Instant Hand Sanitizer
etanol
Etanolo
ethanol
Ethanol Absolute
Ethanol solution
Ethicap
Ethyl hydroxide
Ethylic alcohol
Ethylol
Etylowy alkohol
Facilipro Hand Sanitizer
Fengliaoxing Fengshi Dieda Yaojiu
Freshorize Hand Sanitizer
Hand Sanitizer Anticeptic
Hand Sanitizer Bodycology
Hand Sanitizer Ultrathon
Hand Sanitizing Blueberry
Hand Sanitizing Lavender
Hand Sanitizing Mandarin
Hand Sanitizing Unscented
Hannaford Hand Sanitizer
Hibiscus Breeze
Higher alcohol distillate
Honeysuckle Ginger Hand Sanitizer
Instant Hand Sanitizer Kickprints
Instantfoam Alcohol Hand Sanitizer
Iris Antimicrobial Hand Sanitizer
Jaysol
Kleenex Moisturizing Instant Hand Sanitizer
Mango Antibacterial Hand Sanitizer
Medichoice Hand Sanitizer
Megafresh Hand Sanitizer
Modesa
Molasses alcohol
Naturals Cucumber Melon Antibacterial Hand
Olive Antibacterial Hand Sanitizer
Orange Blossom Antibacterial Hand
Peppermint Hand Sanitizer
Pomegranate Scented Hand Sanitizer
Preference Hand Sanitizer
Prevail Hand Sanitizer Lemongrass
Prevail Pomegranate Hand Sanitizer
Prevent
Proformance Foam Alcohol Sanitizer
Pumpkin Spice Antibacterial Hand Sanitizer
Punctilious ethyl alcohol
QMHAIh@
Raspberry Hand Sanitizer
Reagent Alcohol
Recens
Regimen
Rubbing
Safeguard Hand Sanitizer
Safesha Lavender
Sanitizer Hand Sanitizer
Sassy Strawberry
Sea Marine Antibacterial
Skintegrity Instant Hand Sanitizer
Softsan
Spirit
Spooky Pumpkin Antibacterial Hand Sanitizer
Spooky Vanilla Antibacterial Hand
Spooky Vanilla Antibacterial Hand Sanitizer
Strawberry Hand Sanitizer
Sunkissed Honeydew Hand Sanitizer
Sunmark Iodides Tincture
Synasol
Tecsol
Thanol
Topcare Apple Pomegranate
Trailways Hand Sanitizer
Unscented Hand Sanitizer
Vanilla Sugar Antibacterial Hand Sanitizer
Vindicator Instant Hand Sanitizer
Vinotinto Hand Sanitizer
Waterless Hand Sanitizer
Absolute ethyl alcohol
Actigel Hand Sanitizer
Advanced Hand Sanitizer
Alcare Foamed Antiseptic Handrub
Alcohol Wipes
Alcool etilico
Alcoscrub Foam
Alcoscrub Hand Cleaner
Anti-bacterial Hand Aromatherapy Stress Relief Eucalyptus Spearmint
Anti-bacterial Hand Sanitizer Eucalyptus Spearmint
Anti-bacterial Hand Sparkling Limoncello
Antibacterial Hand Arctic Blast
Antibacterial Hand Sanitizer Gel
Antibacterial Hand Sanitizer Pomegranate and Acai
Antibacterial Hand Sanitizer Sunflower and Citrus
Antimicrobial Alcohol Hand Wipes
Antimicrobial Hand Sanitizing Lotion Mango Scented
Antimicrobial Hand Wipe
Aogel
Assured Hand Sanitizer With Moisturizers
Aurora Antibacterial Sanitizer Sweet Lychee Berry
Azuro
Bactex Antiseptic Hand Sanitizer
Bella Maison Coconut Pineapple Antibacterial Hand Sanitizer
Bella Maison Tropical Vanilla Antibacterial Hand Sanitizer
Berkley Jensen Instant Sanitizer
Body Luxuries French Lavender Antibacterial Hand Sanitizer
Body Luxuries Tihitian Vanilla Antibacterial Hand Sanitizer
Body Luxuries Vanilla Frosting Antibacterial Hand Sanitizer
Bodycology Cherry Blossom Hand Sanitizer
Bodycology Cucumber Melon Hand Sanitizer
Bodycology Moisturizing Hand Sanitizer Brown Sugar Vanilla
Bodycology Sweet Petals
Care
Careone Antibacterial Hand Sanitizer Pumpkin Roll
Careone Antibacterial Sanitizer Pecan Pumpkin Pie
Careone Lemon
Cinnamon Sugar
Claires Fancy Nancy Antibacterial Glamourous Grape
Clear Defense
Clinishield Instant Hand Sanitizer Fragrance Free
Coconut Lime Antibacterial Hand Sanitizer
Cologne Spirit
Compact Hand Sanitizer
Cranberry Cake
Cvs Pharmacy Advanced Tangerine
Dawnmist Alcohol Hand Sanitizer
Defender Foaming Hand Sanitizer
Dermacen Instant Hand Sanitizer
Desinfektol EL
Desmanol Pure
Digisan Hand Sanitizer
Disney Princess Raspberry Scented Antiseptic Hand Cleansing
Dreumex Omnicare Hand Sanitizer
Dynarex Green
Enchanted Moments Mistletoe Kisses Hand Sanitizer
Ethanol Vapor
ethyl alcohol
Ethyl alcohol anhydrous
Ethyl alcohol,absolute
Ethyl hydrate
Ethyloxy Group
EtOH
Everyone Hand Sanitizer Peppermint Citrus
Fast
Floral Frenzy
Foaming Hand Sanitizer
Foaming Sanitizing Hand
Freeman Packaging Hand Sanitizer
Fresh Cucumber Melon Bodycology
Gbgf
Genuine Hand Sanitizer
Goongsecret Hands Clean
grain alcohol
Hand Sanitizer Orange Tangerine
Hand Sanitizer Prevail
Hand Sanitizer Spicy Peppermint
Hand Sanitizer Spraying
Hand Sanitizer With Moisturizers
Hawaiian Passion Hand Sanitizer
Healthcare Instant Hand Sanitizer Strawberry Scent
Hibiscus Coconut Hand Sanitizer
Hillyard Instant Hand Sanitizer
Hydrating Instant Hand Sanitizer
Icing
Infectiguard Fast Acting Antiseptic Hand Sanitizer
Infectiguard Fast Acting Antiseptic Hand Sanitizer With Moisturizer
Infinity Pure
Instant Hand Antiseptic
Instant Hand Sanitizer
Instant Hand Sanitizer Lavender
Instant Hand Sanitizer Original
Instant Hand Sanitizer Strawberry Scented
Instant Hand Sanitizer Twisted Peppermint
Instant Hand Sanitizer Unscented
Instant Hand Sanitizer With Moisturizers
Instant Hand Sanitizer With Moisturizers Unscented
Irresistible Apple Scented Hand Sanitizer
Jingle Berry Scented Antibacterial Hand Sanitizer
Kleenex Hand Sanitizer
Kleenex Ultra Moisturizing Hand Sanitizer
Knockout Hand Sanitizer
Lavender De Provence Antibacterial Hand Sanitizer
Lavender Hand Sanitizer
Lemon Thyme Antibacterial Hand Sanitizer
Letters Lavender Hand Sanitizer
Luscious Lime
Mandarin Orange and Lemon Antibacterial Sanitizer
Mckesson Hand Sanitizer
Modesa Antibacterial Hand Sanitizer Lemon
Mommy Tillia Antibacterial Hand
Naturals Pomegranate and Mango Antibacterial Hand
Novaclenz Instant Hand Sanitizer
Ocean Breeze Antibacterial Hand
Orange Spice Scented Antibacterial Hand Sanitizer
Organic Lavender Hand Sanitizer
Panrosa Instant Antiseptic Hand Sanitizer With Moisturizers
Papaya Mango Antibacterial Hand
Perfect Purity Advanced Hand Sanitizer Refreshing
Pomegranate Rose Hand Sanitizer
Potato alcohol
Premium Hand Sanitizer
Prevent Hand Sanitizer
Procure Hand Sanitizing
Purell Advanced Hand Sanitizer Refreshing Florals
Purell Advanced Hand Sanitizer Winterberry Delight
Purell Advanced Refreshing Aloe
Purell Personal Pack Sanitizing
Purell Waterless Surgical Scrub
Puritan Hand Sanitizer
Quality Choice Iodides Tincture
Raspberry Vanilla Scented Waterless Hand Sanitizer
Reagent Alcohol, spectrophotometric grade
Sani
Sanifoam Hand Sanitizer
Sanigizer Plus
Sanitizing Alcohol Rub
Scott Moisturizing Instant Hand Sanitizer
Septosan Hand Sanitizer
Shopkins Hand Sanitizer
Signature Alcohol Foaming Hand Sanitizer
silent spirit
Skintegrity Foaming Hand Sanitizer Fragrance Free
Softsoap Instant Hand Sanitizer With Moisturizers
spiritus vini
Spirt
Sterillium Med
Sterillium Rub
Sugar Cookies Scented Antibacterial Hand Sanitizer
Sugared Pear Antibacterial Hand Sanitizer
Sweet Daisy Antibacterial Hand Sanitizer
Sweet Lemon Antibacterial Hand Sanitizer
Swiss Hand Guard Antiseptic Handwash Antibacterial
Symmetry Foaming Hand Sanitizer
Symmetry Foaming Hand Sanitizer-unscented
Symmetry Hand Sanitizer
Sysco Reliance
Topcare Hand Sanitizer
Vanilla Bean Antibacterial Hand
Vanilla Bean Antibacterial Hand Sanitizer
Vanilla Hand Sanitizer
Vanilla Mint Antibacterial Hand Sanitizer
Vanilla Sugar Antibacterial Hand
Walgreens Instant Hand Sanitizer
Waterless Lavender Scented Hand Sanitizer
Winter Vanilla Hand Sanitizer Bodycology
Xtracare Cucumber Melon
Xtracare Instant Hand Sanitizer
Xtracare Instant Hand Sanitizer Original
Zep Professional Alcohol Hand Sanitizing
Zylast Antiseptic Surgical Scrub
Aidplus Alcohol Cleansing Pad
Aire-master
Alcare Hand Degermer
Alcohol Foaming Hand Sanitizer
Alcohol Swab
American Infection Control Antiseptic Body Wipes
American Infection Control Antiseptic Hand Wipes
Angel Foodcake Hand Sanitizer
Anti Bacterial Hand Sanitizer
Anti-bacterial Hand Copacabana Coconut
Anti-bacterial Hand Fresh Strawberries
Anti-bacterial Hand Marshmallow Mittens
Anti-bacterial Hand Sanitizer
Anti-bacterial Hand Sanitizer Fresh Strawberries
Anti-bacterial Hand Stache Pomegranate
Anti-bacterial Hand Twisted Peppermint
Anti-bacterial Hand Watermelon Lemonade
Antibacterial Hand Candy Cane
Antibacterial Hand Polar Mint
Antiseptic Hand Cleansing Gel
Aplicare Antiseptic Hand Rinse
Assured Aloe
Assured Instant Hand Sanitizer
Body Luxuries Moroccan Rose Antibacterial Hand Sanitizer
Body Luxuries Waterless Hand Sanitizer
Bodycology Sweet Petals Hand Sanitizer
Bortons Ethyl Rubbing Alcohol
Candy Apple
Careone Antibacterial Hand Sanitizer Winter Sky
Celox Ultra
Charlie Girl Grape Antibacterial Hand Sanitizer
Cherry Blossom Waterless Anti-antibateria Hand Sanitizer
Citrus Hand Sanitizer
Clara Instant Waterless Hand Sanitizer
Clario Instant Hand Sanitizer
Clean Choice Alcohol Sanitizer
Clean Hand Sanitizer
Clinical Works Lavender Blossom Waterless Hand Sanitizer
Clorox Hand Sanitizer
Coconut Vanilla Hand Sanitizer
Command Antibac Instant Hand Sanitizer
Cotton Blossom Waterless Anti-antibateria Hand Sanitizer
Cotton Candy
Cranberry Cherry Scented Hand Sanitizer
Cucumber Melon Hand Sanitizer
Deb Instantfoam Alcohol Hand Sanitizer
Elyptol Antimicrobial Hand Gel
EOH
EOX
Essence Of Beauty Japanese Garden Antibacterial
Ethanol, undenatured
Exotic Cherry Hand Sanitizer Bodycology
Facilipro Waterless Hand Rinse
fermentation alcohol
Frais Hand Sanitizer
Fresh Decor Citrus Pomegranate
Fresh Lavender Waterless Anti-antibateria Hand Sanitizer
Frosted Sugar Cookie
Gbg
Gbg Aloegel
Georgia-pacific Alcohol Hand Sanitizer
Gerigentle Hand Wipes
Germ Bullet
Gnp Iodides Tincture
Green Tea Antibacterial Hand Sanitizer
Hand Essentials Instant Hand Antiseptic
Hand Sanitizer Cranberry Tart
Hand Sanitizer Juicy Blueberry
Hand Sanitizer Pink Strawberry Lollipop
Hand Sanitizing Teachers Rule Mandarin
Hand Sanitizing Wipes
Handex Instant Hand Sanitizer
Hansan Foam
Hansan Spray
Healthcare Instant Hand Sanitizer Vanilla Scent
Hillyard Foaming Instant Hand Sanitizer
Icee Strawberry Scented Hand Sanitizer
Icing Winterberry Anti-bacterial Hand Sanitizer
Instant Foam
Instant Foaming Hand Sanitizer
Instant Hand Sanitizer and Moisterizer
Instant Hand Sanitizer Convenience Pack
Instant Hand Sanitizer Kuretek
Instant Hand Sanitizer Strawberry Kiss
Jelly Bean Antibacterial Hand
Keystone Liquid Hand Sanitizer
Kleenex Instant Hand Sanitizer
Landrum Instant Hand Sanitizer
Lemon Hand Sanitizer
Little Ones Lavender
Little Ones Original
Lucky Hand Sanitizer Lavender
Lux
Mellow Instant Hand Sanitizer Original
Mousse Vite
Mueller Instant Hand Sanitizer
Ocean Breeze
Ocean Hand Sanitizer
Orange Scented Hand Sanitizer
Peppermint Hand Sanitizer None
Pure Spring
Pure Spring Strawberry and Pomegranate
Purell Advanced Hand Sanitizer Revitalizing Rain
Purell Advanced Hand Sanitizer Spongebob Splash
Purell Advanced Hand Sanitizer Watermelon Splash
Purell Advanced Hand Sanitizer Wintergreen Mint
Purell Advanced Instant Hand Sanitizer
Purell Instant Ultra
Quik-care Antiseptic Handwash
Raining Rose Antiseptic Hand Sanitizer
Recens Foam
Recens Ultra
Refresh Foaming Instant Hand Sanitizer
Renewal Hand Sanitizing Wipes
Royal Hand Sanitizer
Safesha Sweet Orange
Sani Mousse
Sani Spritz
Sani-smooth
Sani-spritz
Saniguard-SF
Scaredy Cat Antibacterial Hand
Silken Hand Sanitizer
Smart San Healthcare Personnel Handwash
Smart Sense Original
Staples Instant Hand Sanitizer
Sterillium Rub Fragrance Free
Superman Berry Scented Antiseptic Hand Cleansing
Sweet Grape Antibacterial Hand
Tc Enrichedfoam Alcohol Hand Sanitizer
Thario Instant Hand Sanitizer
Toasted Vanilla Kit Bodycology
Toasted Vanilla Sugar Hand Sanitizer Bodycology
Topcare Aloe
Topcare Citrus Escape
Topcare Coconut Cream
Toy Cleaner
Triseptin Water Aided
Water Mountain Hand Sanitizer
Waterless Anti Bacterial Hand Sanitizer
Waterless Anti-bacterial Hand Cleanser
Waterless Fragrance Free Hand Sanitizer
Wilde Orchid
Winning Hands Alcohol Foaming
WITCH HAZEL
Witchs Brew Antibacterial Hand
Xtracare Warm Vanilla
Zep Alcohol Sanitizer
Zesty Lemon
1-Hydroxyethane
a polyvinyl alcohol
Al Cafoam
Alcare Plus Foamed Antiseptic Handrub
Alco Hand Sanitizer
Alcohol, anhydrous
Alcohol, dehydrated
Anti-bacterial Hand
Anti-bacterial Hand Bourbon Street Buttercream
Anti-bacterial Hand Caribbean Escape
Anti-bacterial Hand Champagne Sparkle
Anti-bacterial Hand Cleanser
Anti-bacterial Hand Frosted Cranberry
Anti-bacterial Hand Island Margarita
Anti-bacterial Hand Marshmallow Pumpkin Latte
Anti-bacterial Hand Sparklling Sweet Nectarine
Anti-bacterial Hand Stasher
Anti-bacterial Hand Surfside Spritzer
Anti-bacterial Hand Tahitian Paradise
Anti-bacterial Hand Turquoise Waters
Anti-bacterial Hand Watermelon Picnic
Anti-bacterial Hand Winter Wonderland
Antibacterial Hand Icy Mint
Antibacterial Hand Mistletoe and Mint
Antiseptic Hand Gel
Appeal Alcohol Foaming Hand Sanitizer
Apple Blossom Scented Hand Sanitizer
Assured Instant Hand Sanitizer Spray
Avagard D
Avant Foaming Hand Sanitizer
Avant Original Instant Hand Sanitizer
Batman Berry Scented Antiseptic Hand Cleansing
Bea-silky
Blanctis Essence Tooth Whitening Gel
Blockout Foot Wipes
Blue Rasberry Hand Sanitizer
Body Luxuries English Pear Antibacterial Hand Sanitizer
Bodycology Brown Sugar Vanilla Hand Sanitizer
Bubble Gum
Careone Antibacterial Hand Sanitizer Festival Of Lights
Careone Instant Hand Sanitizer Lemon
Cherry Blossom Scented Hand Sanitizer
Clario Foaming Alcohol Instant Hand Sanitizer
Clean All
Clinical Works Cucumber Melon Waterless Hand Sanitizer
Clinical Works Pink Grapefruit Waterless Hand Sanitizer
Coconut Water Scented Hand Sanitizer
Cotton Candy Hand Sanitizer
Ctca Foaming Hand Sanitizer
Cucumber Melon Scented Hand Sanitizer
Derma Stat
Elgin Instant Hand Sanitizer
Enchanted Moments Vanilla Snow Hand Sanitizer
Eo Hand Sanitizer Peppermint
Eo Hand Sanitizer Unscented
Ethanol Absolute Bp
Ethanol Extra Pure
Ethanol, analytical standard
Ethanol, denatured
Ethyl alc
Ethyl alcohol in alcoholic beverages
Everyone Hand Sanitizer Coconut Lemon
Exotic Cherry Blossom Hand Sanitizer
Exotic Cherry Blossom Kit Bodycology
Ezfoam Foaming Alcohol Hand Sanitizer
Fikes Instant Hand Sanitizer
Foam Hand Sanitizer
Forever Hand Sanitizer Hand Sanitizer
Free Hand
Friuts and Flowers Grapefruit Waterless Hand Sanitizer
Frosted Berry Hand Sanitizer
Frosted Cranberry Anti-bacterial Scented Hand Sanitizer
Germ Safe
Goldlove Hand Sanitizer None
Hand and Nature Sanitizer Grapefruit
Hand and Nature Sanitizer Peppermint
Hand Sanitizer Bottle With Carabiner
Hand Sanitizer Sugared Berry
Hand Sanitizer Vanilla Scent
Hand Sanitizing Green Apple
Handi Sani
Handi-sani
Healing Waters Peach Nectarine Hand Sanitizer
Healthy Hands Aloe Instant Hand Antibacterial
Healthy Hands Instant Antiseptic Hand Cleanser
Healthy Hands Instant Antiseptic Hand Cleanser With Moisturizers
Heisclean for Woman
Hes Clean
Husky Instant Hand Sanitizer
Hygiene Master Instant Hand Sanitizer
Instant Foam Hand Sanitizer
Instant Hand Sanitizer Blue Raspberry
Instant Hand Sanitizer Chinese Cherry Blossom
Instant Hand Sanitizer Foam
Instant Hand Sanitizer With Moisturizers Ocean Scented
Jasmine and Green Tea Antibacterial Sanitizer
Justice Mixed Berry Scent Antibacterial Hand Sanitizer
Justice Rhinestone Raspberry Scent Anti-bacterial Hand Sanitizer
Justice Strawberry Scent Anti-bacterial Hand Sanitizer
Kay Alphasan Hand Sanitizer
Kleen Instant Hand Sanitizer With Moisturizers
Kleenex Antiseptic Hand Rub With Moisturizers
Lavender Vanilla Anti-bacterial Hand Sanitizer
Lavender Waterless Hand Wash
Lemon Scented Hand Sanitizer
Lemon Verbena Hand Sanitizer
Letters Lemon Verbena Hand Sanitizer
Lisa Frank Bubblegum Antiseptic Hand Cleansing
Love Hand Sanitizer
Lucky Sanitizing Hand Towels
Mandarin Orange Anti-bacterial Hand Sanitizer
Mango Madness Hand Sanitizer
Mayfair Anti-bacterial Hand Sanitizer
Mcd Hand Sanitizer
Mojito Sun
Naturally Nova Scotia Hand Sanitizer
O Blanctis
One Step Sanitizer
Orchid Antibacterial Vanilla and Apple Blossom
Orchid Sugar Cookie
Passion Fruit Hand Sanitizer
Passion Fruit Kiss
Pc Hansan
PF Hand Sanitizing
Pink Lemonade Hand Sanitizer
Pink Macaroon Hand Sanitizer
Premium Hand Sanitizer Nectarine Mint
Prime-cide
Pro Advantage Instant Hand Sanitizer
Proformance Series Foam Alcohol Hand Sanitizer
Pure Foam
Pure Hands
Purell Advanced Green Certified Instant Hand Sanitizer
Purell Advanced Hand Sanitizer Inspiring Island Getaway
Purell Advanced Hand Sanitizer Moonlit Moments
Purell Advanced Hand Sanitizer Tranquil Sunset
Purell Advanced Hand Sanitizer Warm Fireplace Gathering
Purell Advanced Hand Sanitizer Winter Jubilee
Purell Advanced Hand Sanitizer Winter Wonderland Spice
Purell Advanced Skin Nourishing Instant Hand Sanitizer
Purell Cottony Soft
Purell Sanitizing Hand Wipes
Qsr Hand Sanitizer
Quik Spray
Quik-care
Recens Hand Sanitizer Wipes
Ritz Spritz Mulled Cranberry
Rue Beaute Grapefruit Hand Sanitizer
Rue Beaute Strawberry Hand Sanitizer
Safeway Care Hand Sanitizer
Safeway Instant Hand Sanitizing Wipes
Sani Soft
Sani Wipes
Sani-care
Sani-silk
Sani-soft
Sanisuds Foam Instant Hand Sanitizer
Servo-stat
Spa Originals Instant Hand Sanitizer
Spring Grove Unscented Hand Sanitizer
Stat-foam
Stat-rinse
Sugar Plum
Surgicept Waterless, Surgical Handscrub and Healthcare Personnel Handwash
Sweet Love Hand Sanitizer Bodycology
Sweet Pea
Toasted Vanilla Sugar Kit Bodycology
Vanilla Sugar Hand Sanitizer
Visibly Clean Hand Sanitizer
Warm Vanilla Hand Sanitizer
Waterless Aloe Scented Hand Sanitizer
Waterless Hand Sanitizer Citrus Scent
White Spruce Hand Sanitizer
Wild Strawberry Anti-bacterial Hand Sanitizer
Winning Hands Hand Sanitizer
Xoxo Kit Bodycology
Alcare Or Foamed Antiseptic Handrub
Alcohol, Absolute
ALCOHOL, ANHYDROUS REAGENT
Alcohol, diluted
Amp Instant Hand Sanitizer
Angel Falls Hand Sanitizer
Anti-aging Hand Sanitizer
Anti-bacterial Hand Coconut Cooler
Anti-bacterial Hand Dancing Waters
Anti-bacterial Hand Electric Mango
Anti-bacterial Hand Honeydew Cooler
Anti-bacterial Hand Japanese Cherry Blossom
Anti-bacterial Hand Lemon
Anti-bacterial Hand Pineapple Punch
Anti-bacterial Hand Pumpkin Cupcake
Anti-bacterial Hand Sanitizer Japanese Cherry Blossom
Anti-bacterial Hand Sanitizer Summer Escape
Anti-bacterial Hand Selfie
Anti-bacterial Hand Squad
Anti-bacterial Hand Vanilla Cupcake
Anti-bacterial Hand Winter
Aogel Hand Sanitizer Kids
Apple Blossom Anti-bacterial Hand Sanitizer
Aqua Sunset Hand Sanitizer
Assured Aloe Scented Instant Hand Sanitizer
Avant EX
Blue Paradise Anti-bacterial Hand Sanitizer
Body Luxuries Sweet Lavender Hand Sanitizer
Bodycology Hand Sanitizer Gift Set
Care One Instant Sanitizer
Clean Force Hand Sanitizer
Clear Defense Citrus Sage
Clear Defense Hand Sanitizing Wipes
Clinical Works Ocean Breeze Waterless Hand Sanitizer
Clorox Care Concepts Hand Sanitizer
Cool Clementine Anti-bacterial Scented Hand Sanitizer
Cvs Pharmacy Aloe
Dawnmist Alcohol Gel Hand Sanitizer
Deb Med Instantfoam Hand Sanitizer
Deb Med Instantfoam Optidose Hand Sanitizer
Disney Frozen Berry Scented Antiseptic Hand Cleansing
Enchanted Moments Candy Apple Hand Sanitizer
Enmotion High Frequency Foam Hand Sanitizer
Eo Hand Sanitizer Lavender
Esca Hand Sanitizing Wipes
ethanol-
Ethanol, denatured, Spectrophotometric Grade
Ethyl alcohol usp
Ethyl alcohol, undenatured
Faith Family Ducks Antiseptic Hand Cleansing
Foam Aid
Foamfresh Alco-foam Hand Sanitizer
Fresh Decor Coconut Cream
Fresh Decor Lemon Verbena
Fresh Splash Scented Hand Sanitizer
Frosted Sugar Plum Hand Sanitizer Bodycology
Gbg Aloegel Instant Hand Sanitizer
Ginger Lime Hand Sanitizer
Gingerhead Girl Anti-bacterial Scented Hand Sanitizer
Glitter Ritz Golden Vanilla Embers
Global Clean Instant Hand Sanitizer
Green Apple Hand Sanitizer
Hand and Nature Sanitizer Calendula
Hand and Nature Sanitizer Camellia
Hand and Nature Sanitizer Lavender
Hand and Nature Sanitizer Raspberry
Hand and Nature Sanitizer Rosemary
Hand San
Hand Sanitizer Cds Office Products
Hand Sanitizer Pomegranate Apple With Moisture Beads
Hand Sanitizer W/carabiner
Hand Sanitizing Special Teacher Green Apple
Hand-aid
Healing Waters Aloe Cucumber Hand Sanitizer
Healing Waters Cherry Blossom Scented Waterless Hand Sanitizer
Healing Waters Cotton Blossom Hand Sanitizer
Healing Waters Cucumber Melon Scented Waterless Hand Sanitizer
Healing Waters Lemon Verbena Hand Sanitizer
Health and Beyond Antiseptic Hand Sanitizer
Heisclean for Man
Hello Kitty Hand Sanitizer
Ici Alcohol Hand Sanitizer
Icing Peppermint Candy Anti-bacterial Hand Sanitizer
Ili Hand Sanitizer Instant
Instant Hand Sanitizer Candy Apple
Instant Hand Sanitizer Citrus Scent
Instant Hand Sanitizer Citrus Zest
Instant Hand Sanitizer Gel
Instant Hand Sanitizer Tennder Care
Instant Hand Sanitizer Vanilla Noel
Instant Hand Sanitizer With Moisturizers Aloe Scented
Iso-quin
Jaysol S
Jelly Bean Hand Sanitizer
Justice Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Pineapple Scent Anti-bacterial Hand Sanitizer
Justice Rabbit Strawberry Scent Anti-bacterial Hand Sanitizer
Kindest Kare Foam Antiseptic Handrub With Enhanced Emollients
Kroger Waterless Hand Sanitizer Citrus Scent
Le Techniq Antibacterial Hand Island Citrus
Le Techniq Hand Sanitizer Apple Pomegranate
Lemon Lime Hand Sanitizer
London Hand Sanitizer Vanilla Scent
Lucasol Hand Instant Hand Sanitizer
Mada Hand Sanitizing Wipes
Marvel The Avengers Hand Sanitizer
Med Plus
Medi-pak Performance Instant Hand Sanitizer
Miss Spa
My Little Pony Antibacterial Hand Sanitizer With Moisturizers
Ocean Breeze Scented Hand Sanitizer
Ocean Waterless Hand Wash
Paris Hand Sanitizer Vanilla Scent
Peppermint Ice Anti-bacterial Scented Hand Sanitizer
Perfect Purity Advanced Hand Refreshing Aloe
Piranha Brand Foaming Alcohol Hand Sanitizer
Pure Gel
Purell Advanced Hand Sanitizer Aspen Retreat
Purell Advanced Hand Sanitizer Fresh Peppermint Cheer
Purell Advanced Hand Sanitizer Holiday Spice
Purell Advanced Hand Sanitizer Naturals Gel
Purell Advanced Hand Sanitizer Ultra Nourishing Foam
Purell Advanced Instant Hand Sanitizer Fragrance Free
Raymond Waites Honeysuckle Rose Waterless Anti-bacterial Hand Sanitizer
Recens A
Rite Aid Renewal With Moisturizers
Ru-Tuss Hydrocodone Liquid
Rue21 Doughnut Sprinkles Antibacterial Hand Sanitizer
Rue21 Strawberry Antibacterial Hand Sanitizer
Safeway Care Aloe
Sani Professional Brand Sani-hands
Sani-gel
Sierra Soft Alcohol Hand Sanitizer
Simply Clean Instant Hand Sanitizer
Sj Antibacterial Hand Gel
Smart Sense Aloe
Snappy Apple Scented Hand Sanitizer
Sunshiny Day Scented Hand Sanitizer
Super Suds Anti-bacterial
Sweet Berry Hand Sanitizer
T-chem Antimicrobial Hand
Tampa General Hospital Instant Hand Degermer
Tc Instant Hand Sanitizer
Tecsol C
Tokyo Hand Sanitizer Vanilla Scent
Topcare Vitamin E
Triseptin Hand and Body Antiseptic
Under Paris Hand Sanitizer
Vanilla Cupcake Anti-bacterial Scented Hand Sanitizer
Vanilla Fig Hand Sanitizer
Wegmans Hand Sanitizer Lychee Berry
Wegmans Hand Sanitizer Thai Bamboo
Winter Vanilla Hand Sanitizer None
Wyandotte Sanifect E3
Xtracare Instant Hand Sanitizer Cocoa Butter
Xtracare Sweet Pea Blossom
Zep Instant Hand Sanitizer
Alcohol, ethyl
Alcohol, Grain
Anti-bacterial Hand Beautiful Day
Anti-bacterial Hand Best Friends
Anti-bacterial Hand Boo Ghostly Raspberry
Anti-bacterial Hand Charming Chick Sweet Strawberry
Anti-bacterial Hand Cucumber Mint
Anti-bacterial Hand Elfin Around
Anti-bacterial Hand Firework Fizz
Anti-bacterial Hand Fresh Balsam
Anti-bacterial Hand Gel
Anti-bacterial Hand Georgia Peach
Anti-bacterial Hand Hawaiian Pink Hibiscus
Anti-bacterial Hand Iced White Pomegranate
Anti-bacterial Hand London Cherry Almond Shortbread
Anti-bacterial Hand Magnolias and Mimosas
Anti-bacterial Hand Merry Berry Christmas
Anti-bacterial Hand Merry Cookie
Anti-bacterial Hand Orchard Bloom
Anti-bacterial Hand Orchard Frost
Anti-bacterial Hand Pink Chiffon
Anti-bacterial Hand Pink Prancer
Anti-bacterial Hand Pumpkin Pecan Waffles
Anti-bacterial Hand Shimmer and Champagne
Anti-bacterial Hand South Pacific Sunrise
Anti-bacterial Hand Southern Lemon Chiffon
Anti-bacterial Hand Suncrisp Apple Harvest
Anti-bacterial Hand Sweet Cinnamon Pumpkin
Anti-bacterial Hand White Peach Chardonnay
Berry Sorbet Anti-bacterial Hand Sanitizer
Blanctis Forte II Tooth Whitening
Body Luxuries Cherry Blossom Waterless Anti-bacterial Hand Sanitizer
Body Luxuries Coconut Vanilla Waterless Anti-bacterial Hand Sanitizer
Body Luxuries French Lavender Waterless Anti-bacterial Hand Sanitizer
Body Luxuries Fresh Cotton Hand Sanitizer
Body Luxuries Pineapple Mango Waterless Anti-bacterial Hand Sanitizer
C2H5OH
Coconut Lime Anti-bacterial Hand Sanitizer
Cotton Candy Anti-bacterial Scented Hand Sanitizer
Credit Card Shape Hand Sanitizer
Cvs Pharmacy Hand Sanitizer Aloe
Cvs Pharmacy Instant Hand Sanitizing Wipes
Decon Hand Instant Hand Sanitizer
Dermacen Instant Hand Sanitizer With Aloe
Dignity Health Hand Sanitizer Alcare Plus
Disney Fairies Sweet Berry Scented Antiseptic Hand Cleansing
Disney Minnie Cotton Candy Scented Antiseptic Hand Cleansing
Dr Tichenors First Aid Antispetic
Enbac Skin Antiseptic/sanitizer Contains Aloe Vera
Enchanted Moments Berries and Cream Hand Sanitizer
Eo Hand Sanitizer Lemon
Epi-clenz Instant Hand Antiseptic
Epi-clenz Instant Hand Antiseptic Scented
Essence Of Beauty Citrus Coconuti
Essence Of Beauty Japanese Garden
Essence Of Beauty Vanilla Wishes
Ethanol, technical grade
Ethyl alcohol and water
Ethyl alcohol, anhydrous
Ethyl Alcohol, Denatured
Foam San Hand Sanitizer
Fresh Up Antiseptic Hand
Frosted Berry Hand Sanitizer None
Glitter Ritz Iced Berry
Gum Drop Hand Sanitizer
Hand and Nature Sanitizer Acacia
Hand and Nature Sanitizer Almond
Hand and Nature Sanitizer Avocado
Hand and Nature Sanitizer Jasmine
Hand and Nature Sanitizer Orance
Hand and Nature Sanitizer Tomato
Hand Guard Foaming Instant Hand Sanitizer
Hand Sanitizer Circle K
Hand Sanitizer Sugar Coated Plum
Hand Sanitizer Sweet Sugar Cookie
Hand Sanitizer Winter Jelly Bean
Hand Sanitizer With Aloe
Harmon Face Values Pomegranate Scent Hand Sanitizer
Healing Waters Vanilla Orchid Anti-bacterial Hand Sanitizer
Healing Waters Violet Rose Hand Sanitizer
Health and Beyond Green
Hes Clean Adam
Hes Clean Plus
Icee Blue Raspberry Scented Hand Sanitizer
Instant Hand Sanitizer Aloe Vera
Instant Hand Sanitizer Bubble Gum
Instant Hand Sanitizer Fresh Aloe
Instant Hand Sanitizer Fresh Lemon Scented
Instant Hand Sanitizer Green Apple Scented
Instant Hand Sanitizer Lemon Drop
Instant Hand Sanitizer Sugar Plum
Instant Hand Sanitizer With Aloe
Jasmine Tea and Basil Antibacterial Hand Sanitizer
John Deere Instant Hand Sanitizer
Justice Tucan Strawberry Scent Anti-bacterial Hand Sanitizer
Justice Vanilla Scent Anti-bacterial Hand Sanitizer
Kleenex Moisturizing Hand Sanitizer, Hydrates Skin
Kroger Waterless Hand Sanitizer With Aloe
Le Techniq Aloe
Le Vital Blossom Delight
Le Vital Hidden Passion
Le Vital Japanese Cherry Blossom
Le Vital Vanilla Heaven
Lemon Splash Anti-bacterial Scented Hand Sanitizer
Lemon Verbena Waterless Hand Wash
Letters Ocean Blue Hand Sanitizer
Little Ones Baby Fresh Sanitizer
Love and Beauty Grapefruit Citrus Essence Antibacterial Scented Hand Sanitizer
Lucky Hand Sanitizer Citrus Zest
Mango Papaya Anti-bacterial Scented Hand Sanitizer
One Step Hand Sanitizer
One Step Wipes
Peach Mango Anti-bacterial Hand Sanitizer
Personal Care Hand Sanitizer Aloe
poly(vinyl alcohol) macromolecule
Premium Hand Sanitizer Cucumber Green Tea
Premium Hand Sanitizer With Aloe
Pretty In Paris Hand Sanitizer Bodycology
Prevail White Tea Hand Sanitizer
Purell Advanced Hand Sanitizer Coconut Beach Siesta
Purell Advanced Hand Sanitizer Fresh Peach Blossoms
Purell Advanced Hand Sanitizer Ocean Kiss
Purell Advanced Hand Sanitizer Sprinkled With Love
Purell Advanced Hand Sanitizer Sweet Plum
Purell Advanced Hand Sanitizer Warm Holiday Treats
Quik-care Waterless Antimicrobial Foaming Hand Rub
Rue Beaute Cherry Hand Sanitizer
Rue Beaute Vanilla Cupcake Hand Sanitizer
Rue21 Peppermint Twist Antibacterial Hand Sanitizer
Sani Claw Wipes
Sani-kleen Instant Hand Sanitizer
Santi-gel Instant Hand Sanitizer
Sephora By Opi Moisturizing Hand Sanitizer
Servo Stat-foam
Servo-stat Balm
Smart San Hand Sanitizer
Soft Care Hand Sanitizer
Soft Care Instant Hand Sanitizer
Spirits of wine
Sterile Alcohol Prep Pad
Stoko Gel Instant Hand Sanitizer
Strawberry Shortcake Berry Best Friends Mixed Berry Antiseptic Hand Cleansing
Sunny Day Scented Hand Sanitizer
Sweet Pea Blossom Hand Sanitizer
Sweet Pea Waterless Anti-antibateria Hand Sanitizer
Tork Hand Sanitizer Alcohol Foam
Tork Premium Hand Sanitizer Foam
Tough Guy Instant Hand Sanitizer
Trick Or Treat Antibacterial Hand
Ulta Freshwater Mist Anti-bacterial Hand Sanitizer
Ulta Pomegranate Lime Anti-bacterial Hand Sanitizer
Ulta Sparkling Lemon Anti-bacterial Hand Sanitizer
VANILLA Powder
Vanilla Brown Sugar Scented Hand Sanitizer
Vanilla Cream and Apple Blossom Antibacterial Hand Sanitizer
Vanilla Sugar Anti-bacterial Scented Hand Sanitizer
Viamed Alcohol Prep Pad
Vida Mia Hand Sanitizer
Xtracare Instant Hand Sanitizer Aloe Vera
Zytec Germ Buster Hand Sanitizer
3 Hand Sanitizers
Aethylalkohol [German]
Alco-san Instant Skin Sanitizer
American Continental Techlabs, Llc Instant Hand Sanitizer
Anti-bacterial Hand Black Cherry Merlot
Anti-bacterial Hand Cocoa Mint
Anti-bacterial Hand Coconut Lime Verbena
Anti-bacterial Hand Cool Coconut Colada
Anti-bacterial Hand Fall Lakeside Breeze
Anti-bacterial Hand Fresh Sparkling Snow
Anti-bacterial Hand Gel Caribbean Escape
Anti-bacterial Hand Gel Fresh Picked Strawberries
Anti-bacterial Hand Gel Vanilla Cupcake
Anti-bacterial Hand Give Thanks
Anti-bacterial Hand Harvest Mouse Citrus
Anti-bacterial Hand Hawaii Honolulu Sun
Anti-bacterial Hand Jawesome Sea Breeze
Anti-bacterial Hand Paris Amour
Anti-bacterial Hand Ripe Raspberry Vine
Anti-bacterial Hand Sanitizer Sweet Pea
Anti-bacterial Hand Santa Paws
Anti-bacterial Hand Santa Tizer
Anti-bacterial Hand Savannah Mint Julep
Anti-bacterial Hand Sweet Cinnamon Pumpkin Purrfect Potion
Anti-bacterial Hand Vanilla Berry Sorbet
Antibacterial Hand Sanitizer Basil and Green Tea
Assured Instant Hand Sanitizer With Moisturizers Aloe Vera and Moisturizers
Avant Eco-premium Instant Hand Sanitizer
B4 Hand Sanitizer
Blue Cross Laboratories Hand Rx
Body Blends Apple Attraction Anti-bacterial Hand Sanitizer
Body Blends Citrus Awakening Anti-bacterial Hand Sanitizer
Body Luxuries Strawberry Scented Waterless Anti Bacterial Hand Gel
C2H6O
Cardinal Health Hand Sanitizer With Aloe
Care Bears Cotton Candy Antiseptic Hand Cleansing
CHEMBL545
Chempace Sani-gel Instant Skin Sanitizer
Crisp Apple Hand Sani
Disney Pixar Cars Berry Scented Antiseptic Hand Cleansing
Dots Apple Cinnamon Anti-bacterial Hand Sanitizer
Eo Hand Sanitizer Sweet Orange
Ethanol, silent spirit
Foaming Instant Hand Sanitizer With Aloe
Frosted Berries and Cream Sanitizer Pen
Game Day Msc Mainstreet Collection Hand Sanitizer
Ginger Lime Waterless Hand Wash
Hand and Nature Sanitizer Aloe
Hand and Nature Sanitizer Apple
Hand and Nature Sanitizer Cherry Blossom
Hand and Nature Sanitizer Grape
Hand and Nature Sanitizer Honey
Hand and Nature Sanitizer Kiwi
Hand and Nature Sanitizer Lemon
Hand and Nature Sanitizer Peach
Hand and Nature Sanitizer Peony
Hand and Nature Sanitizer Rose
Hand San Instant Hand Sanitizer
Hand Sanitizer Citrus Coconut With Moisture Beads
Hand Sanitizer Hand Rx
Hand Sanitizer Passion Flower With Moisture Beads
Hand Sanitizing A Plus Teacher Unscented
Harmon Face Values Hand Sanitizer Spray
Healing Waters Cucumber Melon Scented Anti-bacterial Hand Sanitizer
Healing Waters Island Nectar Scented Anti-bacterial Hand Sanitizer
Health and Beyond Instant Hand Sanitizer
Hes Clean Eve
Icee White Cherry Scented Hand Sanitizer
Icing Iced Frosting Anti-bacterial Hand Sanitizer
Ics3 Blue Healthcare Hand Antiseptic
Instant Hand Sanitizer With Shea Butter
Justice Anti Bac Hand Sanitizer
Justice Cactus Vanilla Scent Anti-bacterial Hand Sanitizer
Justice Create Inspire Explore Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Elephant Mango Scent Anti-bacterial Hand Sanitizer
Justice Strawberry Scent Anti Bac Hand Sanitizer
Justice Vanilla Anti Bac Hand Sanitizer
Kindest Kare Air-infused Foam Antiseptic Handrub
Kleenex Hand Sanitizer, Green Certified
LA Mer Hand Sanitizer
Le Techniq Hand Sanitizer Jasmine Basil
Le Vital Berry Kissed
Le Vital Midnight Rush
Love and Beauty Coconut Vanilla Essence Antibacterial Scented Hand Sanitizer
Lucky Instant Hand Sanitizer Citrus Zest
Marvel Ultimate Spider-man Berry Scented Antiseptic Hand Cleansing
Modesa Anti-bacterial Hand Gel
Natural Extensions Fragrance- Free Instant Hand Sanitizer
Nu Skin Epoch
Pretty In Paris Kit Bodycology
Pumpkin Pie Anti-bacterial Scented Hand Sanitizer
Purell Advanced Hand Sanitizer Oven-baked Apples
Purell Advanced Hand Sanitizer Sweet Papaya Mango
Purell Advanced With Aloe Instant Hand Sanitizer
Raymond Waites Gerber Daisy Waterless Anti-bacterial Hand Sanitizer
Reagent Alcohol, reagent grade
Rite Aid Instant Hand Sanitizer
Rite Aid Instant Hand Sanitizer With Moisturizers
Rue21 Cherry Antibacterial Hand Sanitizer
Rue21 Cherry Blossom Antibacterial Hand Sanitizer
Sani-hands Instant Hand Sanitizing Wipes
Saniklean E3 Hand Sanitizer
Smart San Hand Sanitizer Spray
Smart Sense Vitamin E Sanitizer
Soft N Sure Antiseptic
Sukang Alcohol Prep Pads Medium
Susan Winget Mango Orange Hand Sanitizer
Sweet Candy Kiss Sanitizer Pen
Tork Hand Sanitizer Alcohol Gel
Ulta Lavender Woods Anti-bacterial Hand Sanitizer
Ulta Mandarin Mint Anti-bacterial Hand Sanitizer
Ulta Vanilla Sugar Anti-bacterial Hand Sanitizer
Wild Passion Flower Anti-bacterial Hand Sanitizer
Xtracare Hand Sanitizer Moisturize With Vitamin E
3m Avagard Foam
3m Avagard Foaming Instant Hand Antiseptic
3m Avagard Instant Hand Antiseptic With Moisturizers
3p Instant Hand Sanitizer
AC1L19TW
AC1Q31MM
Anti-bacterial Hand A Thousand Wishes
Anti-bacterial Hand Autumn Owl Cranberry Apple
Anti-bacterial Hand Be Joyful
Anti-bacterial Hand Bright Autumn Day
Anti-bacterial Hand Cozy Vanilla Cream
Anti-bacterial Hand Crisp Morning Air
Anti-bacterial Hand French Kiss Berry
Anti-bacterial Hand Fresh Lemon Daisy
Anti-bacterial Hand Fresh Market Apple
Anti-bacterial Hand Gel Mango Madness
Anti-bacterial Hand Gel Pink Lemonade
Anti-bacterial Hand Napa Valley Sunset
Anti-bacterial Hand Perfect Autumn Day
Anti-bacterial Hand Plum Cider Warmth
Anti-bacterial Hand Sanitizer Sugar Lemon Fizz
Anti-bacterial Hand Sweet Pea
Anti-bacterial Hand Tgif Coconut Sugar
Anti-bacterial Hand Vanilla Bean Noel
Anti-bacterial Hand Warm Vanilla Sugar
Anti-bacterial Hand Winter Candy Apple
Antibacterial Hand Polar Mint and Arctic Blast
Antiseptic Hand Gel With Aloe
April Bath and Shower Cucumber Melon Scented Antibacterial Hand Sanitizer
Assured Hand Sanitizer With Aloe Vera
Assured Hand Sanitizer With Vitamin E
Bacti-free Tm Hand Sanitizer
Body Blends Vanilla Sugar Anti-bacterial Hand Sanitizer
Body Luxuries Blueberry Scented Waterless Anti Bacterial Hand Gel
Candy Coated Apple Anti-bacterial Scented Hand Sanitizer
Clean Xpress Alcohol Gel Instant Skin Sanitizer
Cvs Pharmacy Anti-aging Hand Sanitizer
Cvs Pharmacy Instant Hand Sanitizer Fresh Scent
Dots Asian Spice Anti-bacterial Hand Sanitizer
Dr.phi Instant Hand Sanitizer
Epi-clenz Plus Instant Hand Antiseptic
Epi-clenz Plus Instant Hand Sanitizer
Epi-clenz Pure Instant Hand Antiseptic
Essence Of Beauty Snowy Apple
Essence Of Beauty Wind Kissed
Ethanol, anhydrous, denatured
Ethanol, anhydrous, denatured, Spectrophotometric Grade
Ethanol, for residue analysis
Ethylalcohol [Dutch]
Five Photo Brand First Aid Antiseptic
Friuts and Flowers Clean Cotton Waterless Hand Sanitizer
Han-I-foam
Han-I-size
Hand and Nature Sanitizer Apple Mango
Hand E San
Hand Gel Prolim Instant Hand Sanitizer
Hand Sanitizer Moisturizing With Vitamin E and Glycerin
Hand Sanitizer Sun Blossom With Moisture Beads
Hand Sanitizer With Aloe Vera
Hand Sanitizer With Moisturizers and Vitamin E
Healing Water Amber Flower Anti-bacterial Hand Sanitizer
Healing Waters Clean Cotton Scented Anti-bacterial Hand Sanitizer
Hes Clean for Woman
Instant Hand Sanitizer With Vitamin E
Justice Cotton Candy Scent Anti-bacterial Hand Sanitizer
Justice Dance Orange Scent Anti-bacterial Hand Sanitizer
Justice Hamburger Green Apple Scent Anti-bacterial Hand Sanitizer
Justice Tortoise Green Apple Scent Anti-bacterial Hand Sanitizer
Klar and Danver Instant Hand Santizer
LA Bodies Purita Anti-bacterial Hand Sanitizer
Le Vital Dreamy Glow
Microban 80
My Little Pony Grape Antiseptic Hand Cleansing
On Guard Hand Sanitizing Wipe
One Step Hand Sanitizer Aloe
Pdi Alcohol Swabstick Threes and Ones
Pink Grape Fruit Waterless Anti-bacterial Hand Sanitizer
Purell Advanced Hand Sanitizer O Christmas Tree
Purse Essentials Hand Sanitizer Anti-bacterial Hand Berry Sorbet
Purse Essentials Hand Sanitizer Anti-bacterial Hand Vanilla Sugar
Reagent Alcohol, ACS reagent
Rue21 Cotton Candy Antibacterial Hand Sanitizer
Rue21 Midnight Musk Antibacterial Hand Sanitizer
Rue21 Ocean Breeze Antibacterial Hand Sanitizer
Rue21 Posh Antibacterial Hand Sanitizer
Rue21 Sugar Cookie Antibacterial Hand Sanitizer
Rue21 Vanilla Spice Antibacterial Hand Sanitizer
San-E-foam
Sani Professional Brand Sani-hands Instant Hand Sanitizing Wipes
Sani-hands for Kids
SDA 3A
Smart San Hand Sanitizer Spray Fragrenace-free
Soft Care Foam Instant Hand Sanitizer
Soft Care Fragrance Free Instant Hand Sanitizer
Soft N Sure Foamed Antiseptic Handrub
Stoko Gel Free Instant Hand Sanitizer
Sundrops 73
Sweet Pea Anti-bacterial Scented Hand Sanitizer
SY Fresh M
Topcare Jasmine Tea and Basil
Virx Instant Hand Sanitizer With Security Clip
ACMC-1AT5A
Aethanol [German]
Alkoholu etylowego [Polish]
Anti-bacterial Hand Berry Scary Ghoul Friend
Anti-bacterial Hand Candy Cane Bliss
Anti-bacterial Hand Fiji White Sands
Anti-bacterial Hand Gel Candy Apple
Anti-bacterial Hand Gel Cotton Candy
Anti-bacterial Hand Hoot Eerie Pear
Anti-bacterial Hand Oh Snap
Anti-bacterial Hand Red Velvet Cheer
Anti-bacterial Hand Spray Sweet Pea
Anti-bacterial Hand Spray Warm Vanilla Sugar
Anti-bacterial Hand Sunlight and Apple Trees
Anti-bacterial Hand Sweet Peach Tea
Anti-bacterial Hand Twisted Web Creepy Orange
Anti-bacterial Hand Wicked Plum Vampire Blood
Body Luxuries French Lavender Scented Waterless Anti Bacterial Hand Gel
Careone Instant Hand Sanitizer With Moisturizers and Vitamin E
CID702
Clean N Fresh Instant Hand Sanitizer
Cvs Pharmacy With Vitamin E
Dehydrated Alcohol, pharmaceutical secondary standard; traceable to USP
Denatured alcohol CD-5
Denatured alcohol CD-5a
Denatured alcohol SD-1
Denatured alcohol SD-3a
Essence Of Beauty Lilies and Freesia
Essence Of Beauty Sugar Frosted Mint
Etanolo [Italian]
Ethanol, denatured, special
Ethanol, for UV Spectrocopy
Ethyl Alcohol 70 Percent Readyincase
Fresh Decor Basil Green Tea
Hand and Nature Sanitizer Green Tea
Hand and Nature Sanitizer White Musk
Hand-E XL
Harmon Face Values Cherry Blossom Scent Hand Sanitizer
Harmon Face Values Cucumber Melon Scent Hand Sanitizer
Healing Waters Sweet Pea Lily Hand Sanitizer
Healing Waters Sweet Pea Scented Anti-bacterial Hand Sanitizer
Healing Waters White Tea Pear Hand Sanitizer
Health Care Instant Hand Sanitizer Ice Clear
Hello Kitty By Sanrio Hand Sanitizer
Instant Hand Sanitizer Original With Moisturizer and Vitamin E
Instant Hand Sanitizer Unscented With Moisturizer and Vitamin E
Instant Hand Sanitizer With Moisturizers and Vitamin E
Instant Hand Sanitizer With Shea Butter Beads
Justice Bubble Gum Scent Anti-bacterial Hand Sanitizer
Justice Latte Cotton Candy Scent Anti-bacterial Hand Sanitizer
Justice Letter A Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter B Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter C Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter D Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter E Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter G Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter H Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter I Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter J Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter K Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter L Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter M Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter N Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter P Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter R Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter S Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Letter T Blueberry Scent Anti-bacterial Hand Sanitizer
Justice Vanilla Scent Anti Bac Hand Sanitizer
Le Vital Sweet Pea
Love and Beauty Floral Rose Essence Antibacterial Scented Hand Sanitizer
Love and Beauty Lemon Fresh Essence Antibacterial Scented Hand Sanitizer
Love and Beauty Sweet Berry Essence Antibacterial Scented Hand Sanitizer
Lucky Hand Sanitizer With Aloe Vera
Lucky Hand Sanitizer With Vitamin E
Medi-pak Performance Instant Hand Sanitizer With Aloe
Pdi Sani-hands Instant Hand Sanitizing Wipes
Pure Spring Lemon and Mint
Purell Advanced Hand Sanitizer Grandma S Apple Delight
Purse Essentials Hand Sanitizer Anti-bacterial Hand Wild Passion Flower
Reagent Alcohol, used for histology tissue preparation
Rue21 Apple Spice Antibacterial Hand Sanitizer
Sani Professional Brand Sani-handsinstant Hand Sani Instant Hand Sanitizing Wipes
Sani-professional Sani-hands Made With Tencel
SD 3A
Select Antiseptic Hand Gel With Aloe
Strawberry Antibacterial Hand Sanitizer With Aloe and Vitamin E
Susan Winget Berries and Cream Hand Sanitizer
Take Care Clinic Instant Hand Sanitizer Spray
[OEtH]
2-pack Hand Sanitizer
3 Hand Sanitizers Kit
3 Pack Instant Hand Sanitizer With Moisturizers
3m Avagard D
Alcool ethylique [French]
Alcool etilico [Italian]
Alkohol [German]
Anti-bacterial Hand Gel Apple Pie
Anti-bacterial Hand Gel Sweet Pea
Anti-bacterial Hand Help Me Cranberry Sauce
Anti-bacterial Hand I Love Glitter
Anti-bacterial Hand Italy Tuscan Lemon Tart
Anti-bacterial Hand Ocean for Men
Anti-bacterial Hand Paris Pink Champagne and Tulips
Anti-bacterial Hand Pretty In Pink
Anti-bacterial Hand Tis The Season
Ben E.keith Hand Cleaner
Body Blends Coconut Lime Escape Anti-bacterial Hand Sanitizer
Body Luxuries Dahlia Blossom Scented Waterless Anti Bacterial Hand Gel
Cologne spirits (alcohol)
Cvs Pharmacy Foam Hand Sanitizer With Aloe
Eclair Naturals (vanilla Peppermint) Hand Sanitizer
Ethanol, standard for GC
Ethyl Alcohol 40%
Ethyl Alcohol 70%
Ethyl Alcohol 75%
Ethyl Alcohol 80%
Ethyl Alcohol 90%
Etylowy alkohol [Polish]
Fair and Square Antibacterial Hand Sanitizer With Vitamine E
Good To Go Hand Sanitizer
GTPL2299
Hand Sanitizer Lemon Scent Hand Rx
Hand Sanitizer With Moisturizers Vitamin E and Aloe
Harris Teeter Hand Sanitizer With Vitamin E
Heb Jasmine Tea and Basil
HSDB 82
Instant Hand Sanitizer - Original
Instant Hand Sanitizer - Strawberry Scented
Instant Hand Sanitizer Extra Enriched With Vitamin E Strawberry Scent
Instant Hand Sanitizer With Moisturizers All In One
Justice Bff Cotton Candy Scent Anti-bacterial Hand Sanitizer
Justice Fruit Scent Anti Bac Hand Sanitizer
Justice Grape Scent Anti Bac Hand Sanitizer
Justice Mermaid Mix Berry Scent Anti-bacterial Hand Sanitizer
Justice Mixed Berry Anti Bac Hand Sanitizer
Justice Pop Corn Vanilla Scent Anti-bacterial Hand Sanitizer
KSC353A0H
Lavender Antibacterial Hand Sanitizer With Aloe and Vitamin E
Lucky Instant Hand Cleanser With Aloe Vera
Lucky Instant Hand Cleanser With Vitamin E
Lucky Instant Hand Sanitizer With Aloe Vera
Lucky Instant Hand Sanitizer With Vitamin E
Lucky Instant Hand Sanitizer With Vitamin E and Moisturizers
Pdi Sani-handsinstant Hand Sani Instant Hand Sanitizing Wipes
Purell Advanced E3 Rated Instant Hand Sanitizer
Reagent Alcohol, for HPLC
Rite Aid Renewal Moisturizers and Vitamin E
Sani-hands II Instant Hand Sanitizing Wipes
Smart San Es Hand Sanitizer Spray
Whiskcare 373
Whiskcare 375
3 Pack Instant Hand Sanitizer With Moisturizers Lavender Scented
6869AF
Alcohol (ethyl alcohol)
Alcohol (USP)
Alcohol [USP]
Alpha E-3
Aniosgel 85 Npc
Anti-bacterial Hand I Donut Care
Anti-bacterial Hand Need A Hand Starbright Citrus
Anti-bacterial Hand Snow Day Ice Blizzard
Apple Antibacterial Hand Sanitizer With Aloe and Vitamin E
April Bath and Shower Sweet Pea Scented Antibacterial Hand Sanitizer
April Bath and Shower Warm Vanilla Sugar Scented Antibacterial Hand Sanitizer
Assured Instant Hand Sanitizer With Moisturizers Vitamin E and Aloe
Avant Original - Fragrance Free
Body Luxuries English Pear Scented Waterless Anti Bacterial Hand Gel
Body Luxuries Lotus Flower Scented Waterless Anti Bacterial Hand Gel
Body Raves Antibacterial Hand Sanitizer - Lavender Vanilla
CDA 19
Cvs Pharmacy Instant Hand Sanitizer With Moisturizers and Vitamin E
Dehydrated ethanol (TN)
Denatured alcohol CD-10
Denatured alcohol SD-13a
Denatured alcohol SD-17
Denatured alcohol SD-23a
Denatured alcohol SD-28
Denatured alcohol SD-30
Denatured alcohol SD-39b
Denatured alcohol SD-39c
Denatured alcohol SD-40m
Enmotion Foam Hand Sanitizer W-moisturizers, Fragrance Free
Ethanol [JAN]
Ethyl alcohol (Ethanol)
Ethyl Alcohol 70 Percent
Fair and Square Antibacterial Hand Sanitizer With Aloe Vera
Family Dollar Instant Hand Sanitizer With Moisturizers and Vitamin E
Harmon Face Values Warm Vanilla Sugar Scent Hand Sanitizer
IMS 99
Instant Hand Sanitizer - Vanilla Scented
Justice Cotton Candy Scent Anti Bac Hand Sanitizer
Justice Mixed Berry Scent Anti Bac Hand Sanitizer
Justice Puppy Love Cotton Candy Scent Anti-bacterial Hand Sanitizer
Kroger Waterless Hand Sanitizer Citrus Scent With Moisturizers and Vitamin E
Le Vital Moon To Light
Rue21 Ocean Anti-bacterial Hand Sanitizer
Sani Professional Brand Sani-hands With Tencel Instant Hand Sanitizing Wipes
Stoko Refresh 4in1 Instant Hand Sanitizer
Virx Instant Hand Sanitizer With Moisturizers and Vitamin E
Whiskcare 375 Fragrance Free
100C.NPA
3 Pack Family Dollar Instant Hand Sanitizers
Alcohols, C30
Aloe Scent A B Hand Sanitizing
Alpet E3 Plus Hand Sanitizer Spray
Anti-bacterial Hand Jingle All The Way
Anti-bacterial Hand New York Big Apple Sparkler
Bd E-Z Care
Body Raves Antibacterial Hand Sanitizer - Wild Strawberry
CCRIS 945
Chemco Anisha K. Instant Skin Sanitizer
CTK2F3003
Duplicating Fluid 100C.NPA
E1510
E7023_ALDRICH
E7148_ALDRICH
Eclair Naturals (french Lavender) Hand Sanitizer
Esumiru WK 88
Ethanol 200 proof
Facility Maintenance Instant Hand Sanitizer Hs-67
HMDB00108
I Love Ny Hand Sanitizer Vanilla Scent
Instant Hand Sanitizer - Clear
Instant Hand Sanitizer Extra Enriched With Vitamin E Bead Strawberry Scent
Instant Hand Sanitizer Extra Enriched With Vitamin E Vanilla Scent
Isagel B-I-B
Justice Blue Berry Scent Anti Bac Hand Sanitizer
Ke-53ps Hand Sanitizer
Love and Beauty Peach Mango Anti-bacterial Hand Sanitizer
Northside Hospital Amenity Kit--gi Dept
Ocean Breeze Antibacterial Hand Sanitizer With Aloe and Vitamin E
Out Of The Blue Scented Hand Sanitizer
Pier 1 Imports Blueberry Parfait Anti-bacterial Hand Sanitizer
Pier 1 Imports Lavender Anti-bacterial Hand Sanitizer
Purell Advanced E3 Rated Instant Hand Sanitizer Foam
Rue21 Island Fruits Anti-bacterial Hand Sanitizer
SD Alchol 23-hydrogen
SD alcohol 23-hydrogen
Symmetry Hand Sanitizer With Aloe and Vitamin E
Well At Walgreens Advanced Hand Sanitizer With Vitamin E
Whole Health Hand Sanitizers 3-pack
WLN: Q2
Xtracare Hand Sanitizer Moisurize With Vitamin E and Aloe
3 Pack Instant Hand Sanitizer With Moisturizers Aloe Scented
Alcohol Determination-Alcohol, United States Pharmacopeia (USP) Reference Standard
All Fresh By Alsco Instant Mist Hand Sanitizer
Alpha E-3 Instant Hand Sanitizer
Amoray Premium Instant Hand Sanitizer With Aloe and Vitamin E Strawberry
Anti-bacterial Hand Meet Me In Paris
Careone Instant Hand Sanitizer With Aloe and Vitamin E
Citrus Hand Sanitizer With Vitamin E and Aloe
DB00898
E2385_SIGMA
E7517_SIGMA
Endure 300 Hand Sanitizer
Endure 450 Surgical and Healthcare Personnel Hand Antiseptic With Moisturizers
Ethanol, Alcohol Reagent, anhydrous, denatured
Ethyl Alcohol Absolute, ACS/USP Grade
First Aid Plus More Alcohol Prep Pad
Instant Hand Sanitizer - Cocoa Butter
Instant Hand Sanitizer With Aloe and Vitamin E
Kroger Waterless Hand Sanitizer With Aloe With Moisturizers and Vitamin E
Le Vital Wake Me Up
Marvel Iron Man 3 Hand Sanitizer
NSC85228
Pdi Alcohol Prep Pad Large and Medium
Pdi Alcohol Prep Pad Sterile Large and Medium
Pdi Sani-hands Alc Antimicrobial Alcohol Gel Hand Wipes
Pier 1 Imports Cherry Anti-bacterial Hand Sanitizer
Reagent Alcohol, 70%
Reagent Alcohol, 80%
Reagent Alcohol, 95%
RL04444
Rue21 Coco Breeze Anti-bacterial Hand Sanitizer
Sani Professional Brand Sani-hands for Kids Instant Hand Sanitizing Wipes
Symmetry Foaming Hand Sanitizer With Aloe and Vitamin E
Ultra Care-aid Sanitizer Antiseptic Hand Sanitizer Citric Fragrance With Aloe Vera
Vanilla Hand Sanitizer With Vitamin E and Aloe
2858_SIGMA
ALCOHOL 5% AND DEXTROSE 5%
Amoray Premium Instant Hand Sanitizer With Aloe and Vitamin E Lavender
Amoray Premium Instant Hand Sanitizer With Aloe and Vitamin E Original
Anti-bacterial Hand Ooh LA LA French Blooms
Anti-bacterial Hand Sanitizer 2 Pack Blue Sunshiny Scented
Anti-bacterial Hand Sanitizer 2 Pack Splash Apple Scented
Berry Hand Sanitizer With Vitamin E and Aloe
bmse000297
C00469
D00068
Dehydrated Alcohol, United States Pharmacopeia (USP) Reference Standard
DSSTox_CID_584
E7023_SIAL
E7148_SIAL
Endure 320 Advanced Care Waterless Antimicrobial Hand Rinse With Moisturizers
Ethanol (9CI)
Ethanol, denatured 1L
Fresh Hand Sanitizer With Vitamin E and Aloe
Hand Sanitizer Gift Set 3-pack
Handy Solutions Instant Hand Sanitizer With Aloe and Vitamin E
Harris Teeter Hand Sanitizer With Vitamin E and Aloe
Husky 515 Instant Hand Sanitizer
Instant Hand Sanitizer - Ice Clear
Instant Hand Sanitizer Extra Enriched With Vitamin E Bead Vanilla Scent
Instant Hand Sanitizer Extra Enriched With Vitamin E Lemon Fresh Scent
Ke-53ps Gel Hand Sanitizer
LTBB002977
Mellow Instant Hand Sanitizer With Aloe and Vitamin E
nchembio.94-comp20
Pier 1 Imports Crisp Bamboo Anti-bacterial Hand Sanitizer
Pier 1 Imports Ginger Peach Anti-bacterial Hand Sanitizer
Pier 1 Imports Lily Blossom Anti-bacterial Hand Sanitizer
Pier 1 Imports Passion Fruit Anti-bacterial Hand Sanitizer
Pier 1 Imports Sugared Plum Anti-bacterial Hand Sanitizer
Pier 1 Imports Vanilla Mint Anti-bacterial Hand Sanitizer
Rue 21 Legend Blueberry Anti Bacterial Hand Sanitizer
Rue 21 Paris Creamsicle Anti Bacterial Hand Sanitizer
Rue 21 Young Strawberry Anti Bacterial Hand Sanitizer
Symmetry Foaming Hand Sanitizer Fragrance Free With Aloe and Vitamin E
Symmetry Foaming Hand Sanitizer-fragrance Free With Aloe and Vitamin E
Triton Hs-777
Up and Up Alcohol Prep Pad
24102_RIEDEL
24103_RIEDEL
24105_RIEDEL
24106_RIEDEL
24194_RIEDEL
32205_RIEDEL
32221_RIEDEL
32294_RIEDEL
34963_RIEDEL
40210_ALDRICH
40210_RIEDEL
48075_SUPELCO
AHD 2000
Aire-master Sanitizer Gel Vit E/a
ALCOHOL 5% IN DEXTROSE 5%
Alcohol, United States Pharmacopeia (USP) Reference Standard
Anhydrol PM 4085
Anhydrous ethanol (JP17)
Antibacterial Hand Gift Set Icy Mint and Candy Cane
Antiseptic Hand Sanitizing Wipe Enriched With Vitamin E and Aloe Vera
Cvs Pharmacy Instant Hand Sanitizer With Aloe and Vitamin E
DAP000681
DTXSID9020584
Easy To Break-off Cleaning and Disinfecting Swabstick Jjb-I
Ethanol, anhydrous, denatured, HPLC Grade
Ethyl Alcohol Absolute (Organic) USP Grade
FEMA Number 2419
Health and Beyond Instant Hand Sanitizer Twin Pack Twin Pack
Instant Hand Sanitizer (gel-type)
Instant Hand Sanitizer Original With Aloe Vera and Vitamin E
Instant Hand Sanitizer With Moisturizers (aloe Vera and Moisturizers)
Love and Beauty Melon and Mint Anti-bacterial Hand Sanitizer
LS-1539
nchem.651-comp3c
OR034186
OR208849
OR242365
OR245565
OR271134
OR369097
Pdi Sani-hands for Kids Antimicrobial Alcohol Gel Hand Wipes
Pier 1 Imports Iced Cookie Anti-bacterial Hand Sanitizer
Purell Instant Hand Sanitizer Foam (ethyl Alcohol)
Rue 21 Apple Anti Bacterial Hand Sanitizer
Rue21 Runway 21 Antibacterial Hand Sanitizer
STL264245
The Fresh Market Hand Sanitizer With Moisturizers Aloe and Vitamin E
UN 1170
02483_FLUKA
02851_FLUKA
02853_FLUKA
02854_FLUKA
02855_FLUKA
02856_FLUKA
02856_SIAL
02857_FLUKA
02857_SIAL
02858_FLUKA
02858_SIAL
02860_FLUKA
02865_FLUKA
02865_SIAL
02870_FLUKA
02870_SIAL
02875_FLUKA
02877_FLUKA
02878_FLUKA
02882_FLUKA
02882_SIAL
02883_FLUKA
02884_FLUKA
02890_FLUKA
02890_SIAL
02891_FLUKA
02891_SIAL
24102_SIAL
24103_SIAL
24105_SIAL
24106_SIAL
24194_SIAL
29221_FLUKA
32205_SIAL
32221_SIAL
32294_SIAL
34870_SIAL
39278_FLUKA
41322_FLUKA
ALCOHOL 10% AND DEXTROSE 5%
Alcohol dehydrated, >=85.0%
Alcohol, pharmaceutical secondary standard: traceable to USP, PhEur
Alcohols, C1-3
Alcohols, C6-9
Anti-bacterial Hand Sanitizer 2 Pack Blue Day Scented
Anti-bacterial Hand Sanitizer 3 Pack Blue Day Scented
Antibacterial Hand - Witchs Brew and Scaredy Cat
CHEBI:16236
CHEBI:17246
D000431
Enmotion Hand Sanitizer With Moisturizers, Fragrance Free, Dye Free
Ethyl Alcohol 47.5%
Ethyl Alcohol 95% ACS/USP Grade
Ethyl Alcohol Absolute (Synthetic) ACS/USP Grade
ETHYL, 2-HYDROXY-
Fatty Alcohol C8-10
Hand and Nature Sanitizer Peach 250ml
Instant Hand Sanitizer Extra Enriched With Vitamin E Bead Lemon Fresh Scent
Janitech Jan-HS-40 Instant Hand Sanitizer
Just 4 Girl Waterless Anti Bacterial Hand Sanitizer Berry Blast
My Instant Hand Sanitizer With Aloe and Vitamin E
nchembio.552-comp10
NCI-C03134
Ru-Tuss Expectorant (Salt/Mix)
Rue 21 Fallen Vixen Anti Bacterial Hand Sanitizer
Rue 21 Queen Cherry Anti Bacterial Hand Sanitizer
Rue 21 Sugar Cookie Anti Bacterial Hand Sanitizer
United Laboratories 464 Pump and Protect Alcohol Hand Sanitizer
(C6-C9)Alkyl alcohol
187380_ALDRICH
245119_ALDRICH
270741_ALDRICH
277649_ALDRICH
3K9958V90M
458600_ALDRICH
459828_ALDRICH
459836_ALDRICH
493538_ALDRICH
493546_ALDRICH
Amoray Premium Instant Hand Sanitizer With Aloe and Vitamin E Fresh Citrus
AN-41865
Anti-bacterial Hand Sanitizer 3 Pack 2
ANW-42207
DSSTox_GSID_20584
Ethanol, >=99.5%
Ethanol, technical grade, 93%
Ethanol, technical grade, 99%
Ethyl alcohol & water, 5%
Health Smart Instant Hand Sanitizer With Aloe Vera and Vitamin E
Health Smart Instant Hand Sanitizer With Aloe Vera and Vitamin E Lavender
Ihs 2000 Instant Hand Sanitizer
Mini Hand Sanitizer - Coconut and Lime
Mini Hand Sanitizer - Orange and Lemon
NSC 85228
NSC-85228
Rue 21 Asian Spice Anti-bacterial Hand Sanitizer
Rue 21 Love Cherry Blossom Anti Bacterial Hand Sanitizer
SC-25298
SDA 40-2
The Amazing Spider-man Hand Sanitizer Moisturizing With Vitamin E and Aloe
187380_SIAL
245119_SIAL
270741_SIAL
277649_SIAL
458600_SIAL
459828_SIAL
459836_SIAL
459844_SIAL
493511_SIAL
493538_SIAL
493546_SIAL
676829_SIAL
ALCOHOL 5% IN D5-W
Caswell No. 430
DSSTox_RID_75674
Endure 300 Cida Rinse Gel Antimicrobial Hand Rinse
Ethanol, 99.8%
Ethanol, tested according to Ph.Eur.
Hand Sanitizer Lil Drug Store Products, Inc.
MFCD00003568
Pier 1 Imports Melon and Mint Anti-bacterial Hand Sanitizer
SDM No. 37
ZINC12358605
[CH2Me(OH)]
AI3-01706
Ethanol, UV HPLC spectroscopic, 95%
Ethyl alcohol & water, 10%
Ethyl alcohol & water, 20%
Ethyl alcohol & water, 30%
Ethyl alcohol & water, 40%
Ethyl alcohol & water, 50%
Ethyl alcohol & water, 60%
Ethyl alcohol & water, 70%
Ethyl alcohol & water, 80%
Ethyl alcohol & water, 95%
Ethyl alcohol & water, 96%
Health Smart Instant Hand Sanitizer With Aloe Vera and Vitamin E Cucumber Melon
Health Smart Instant Hand Sanitizer With Aloe Vera and Vitamin E Peach
Instant Hand Sanitizer With Moisturizers (vitamin E and Aloe)
Pacific Garden Foam Hand Sanitizer, Fragrance Free, Dye Free
RTR-022011
Ru-Tuss Liquid (Salt/Mix)
Rue 21 Free Spirit Fresh Flowers Anti Bacterial Hand Sanitizer
TR-022011
UNII-3K9958V90M
AKOS009104571
EPA Pesticide Chemical Code 001501
Justice Love Hugs Me and You Cotton Candy Scent Anti-bacterial Hand Sanitizer
Reagent Alcohol, 70%, used for histology tissue preparation
Reagent Alcohol, 80%, used for histology tissue preparation
Reagent Alcohol, 95%, Used for histology tissue preparation
CDA 19-200
Ethanol, >50% in a non hazardous diluent
Ethanol, Reagent (Denatured SDA 3A)
Ethyl Alcohol 95% (Synthetic) FCC Grade
FEMA No. 2419
FT-0622588
FT-0625728
Health Smart Instant Hand Sanitizer With Aloe Vera and Vitamin E Sweet Pea
Pier 1 Imports Lavender Vanilla Anti-bacterial Hand Sanitizer Pier 1 Imports
Rue 21 Dream Dance Love Vanilla Spice Anti Bacterial Hand Sanitizer
64-17-5
B4 Hand Sanitizer 500 Single-use Packs
Ethanol, >=99.5%, suitable for fluorescence
Ethanol, denatured, (UK IDA standard)
I14-12648
Orchid By H E B Jasmine Tea and Basil
Vida Mia Hand Sanitizer (62%)
3 Pack Assured Instant Hand Sanitizer With Moisturizers (aloe Vera and Moisturizers)
A.B.H.C. Instant Hand Sanitizer Citrus Scent
Ethanol, >=99.5%, suitable for absorption spectrum analysis
Ethanol, technical grade, 93.8%
Ethanol, technical grade, 99.5%
Tox21_202510
3 Pack Assured Instant Hand Sanitizer With Moisturizers (vitamin E and Moisturizers) Lavender Scented
Ethyl Alcohol 95% (Grain Derived) FCC Grade
Ethyl Alcohol 95% (Synthetic) ACS/USP Grade
CAS-64-17-5
Ethanol, USP, 99.5%
Ethyl alcohol (6CI,7CI,8CI)
Reagent Alcohol, anhydrous, <=0.003% water
Reagent Alcohol, anhydrous, <=0.005% water
8000-16-6
8024-45-1
Ethanol, >=99.5%, for HPLC
Ethanol, JIS special grade, >=99.5%
Ethyl alcohol, Pure, 200 proof, HPLC/spectrophotometric grade
MCULE-8818474596
NCGC00091458-01
NCGC00091458-02
NCGC00260059-01
Vida Mia Hand Sanitizer Aloe Vera (62%)
2 Pack Assured Instant Hand Sanitizer With Moisturizers (vitamin E and Aloe)
7-11 Instant Hand Sanitizer With Aloe and Vitamin E
EINECS 200-578-6
EINECS 270-649-4
Ethanol, >=99.5%, SAJ super special grade
Ethanol, SAJ first grade, >=99.5%
68475-56-9
71076-86-3
71329-38-9
Ethanol solution, certified reference material, 2000 mug/mL in methanol
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139-EP2284166A1
139-EP2284167A2
139-EP2284168A2
139-EP2284169A1
139-EP2284170A1
139-EP2284171A1
139-EP2284172A1
139-EP2284174A1
139-EP2284178A2
139-EP2284179A2
139-EP2284920A1
139-EP2286795A1
139-EP2286811A1
139-EP2286812A1
139-EP2286915A2
139-EP2287140A2
139-EP2287141A1
139-EP2287147A2
139-EP2287148A2
139-EP2287150A2
139-EP2287152A2
139-EP2287153A1
139-EP2287154A1
139-EP2287155A1
139-EP2287156A1
139-EP2287158A1
139-EP2287159A1
139-EP2287160A1
139-EP2287161A1
139-EP2287162A1
139-EP2287163A1
139-EP2287164A1
139-EP2287165A2
139-EP2287166A2
139-EP2287167A1
139-EP2287168A2
139-EP2287940A1
139-EP2289483A1
139-EP2289509A2
139-EP2289510A1
139-EP2289868A1
139-EP2289871A1
139-EP2289876A1
139-EP2289877A1
139-EP2289879A1
139-EP2289881A1
139-EP2289882A1
139-EP2289883A1
139-EP2289884A1
139-EP2289885A1
139-EP2289887A2
139-EP2289888A2
139-EP2289890A1
139-EP2289892A1
139-EP2289893A1
139-EP2289894A2
139-EP2289896A1
139-EP2289897A1
139-EP2289965A1
139-EP2292088A1
139-EP2292227A2
139-EP2292228A1
139-EP2292233A2
139-EP2292234A1
139-EP2292280A1
139-EP2292586A2
139-EP2292589A1
139-EP2292590A2
139-EP2292592A1
139-EP2292593A2
139-EP2292596A2
139-EP2292597A1
139-EP2292601A1
139-EP2292602A1
139-EP2292603A1
139-EP2292606A1
139-EP2292607A2
139-EP2292608A1
139-EP2292609A1
139-EP2292610A1
139-EP2292612A2
139-EP2292613A1
139-EP2292614A1
139-EP2292615A1
139-EP2292616A1
139-EP2292617A1
139-EP2292618A1
139-EP2292619A1
139-EP2292620A2
139-EP2292621A1
139-EP2292622A1
139-EP2292625A1
139-EP2292628A2
139-EP2292629A1
139-EP2292630A1
139-EP2293650A1
139-EP2295053A1
139-EP2295055A2
139-EP2295061A1
139-EP2295399A2
139-EP2295406A1
139-EP2295407A1
139-EP2295408A1
139-EP2295409A1
139-EP2295410A1
139-EP2295411A1
139-EP2295412A1
139-EP2295413A1
139-EP2295414A1
139-EP2295415A1
139-EP2295416A2
139-EP2295417A1
139-EP2295418A1
139-EP2295419A2
139-EP2295420A1
139-EP2295421A1
139-EP2295422A2
139-EP2295423A1
139-EP2295424A1
139-EP2295425A1
139-EP2295426A1
139-EP2295427A1
139-EP2295428A2
139-EP2295429A1
139-EP2295430A2
139-EP2295431A2
139-EP2295432A1
139-EP2295433A2
139-EP2295434A2
139-EP2295435A1
139-EP2295436A1
139-EP2295437A1
139-EP2295438A1
139-EP2295439A1
139-EP2295550A2
139-EP2298305A1
139-EP2298312A1
139-EP2298313A1
139-EP2298728A1
139-EP2298729A1
139-EP2298731A1
139-EP2298732A1
139-EP2298734A2
139-EP2298735A1
139-EP2298736A1
139-EP2298737A1
139-EP2298738A1
139-EP2298739A1
139-EP2298740A1
139-EP2298741A1
139-EP2298742A1
139-EP2298743A1
139-EP2298744A2
139-EP2298745A1
139-EP2298746A1
139-EP2298747A1
139-EP2298748A2
139-EP2298749A1
139-EP2298750A1
139-EP2298751A2
139-EP2298752A1
139-EP2298753A1
139-EP2298754A1
139-EP2298755A1
139-EP2298756A1
139-EP2298757A2
139-EP2298758A1
139-EP2298759A1
139-EP2298760A1
139-EP2298761A1
139-EP2298763A1
139-EP2298764A1
139-EP2298765A1
139-EP2298766A1
139-EP2298767A1
139-EP2298768A1
139-EP2298769A1
139-EP2298770A1
139-EP2298771A2
139-EP2298772A1
139-EP2298773A1
139-EP2298774A1
139-EP2298775A1
139-EP2298776A1
139-EP2298778A1
139-EP2298779A1
139-EP2298783A1
139-EP2298828A1
139-EP2299509A1
139-EP2299510A1
139-EP2301533A1
139-EP2301534A1
139-EP2301536A1
139-EP2301538A1
139-EP2301540A1
139-EP2301544A1
139-EP2301627A1
139-EP2301909A1
139-EP2301911A1
139-EP2301912A2
139-EP2301913A1
139-EP2301914A1
139-EP2301916A2
139-EP2301919A1
139-EP2301920A1
139-EP2301921A1
139-EP2301922A1
139-EP2301923A1
139-EP2301925A1
139-EP2301928A1
139-EP2301929A1
139-EP2301931A1
139-EP2301933A1
139-EP2301934A1
139-EP2301935A1
139-EP2301936A1
139-EP2301937A1
139-EP2301938A1
139-EP2301939A1
139-EP2301940A1
139-EP2301941A1
139-EP2301983A1
139-EP2302003A1
139-EP2305033A1
139-EP2305219A1
139-EP2305243A1
139-EP2305250A1
139-EP2305254A1
139-EP2305257A1
139-EP2305260A1
139-EP2305625A1
139-EP2305627A1
139-EP2305629A1
139-EP2305633A1
139-EP2305637A2
139-EP2305640A2
139-EP2305641A1
139-EP2305642A2
139-EP2305643A1
139-EP2305644A1
139-EP2305647A1
139-EP2305648A1
139-EP2305649A1
139-EP2305651A1
139-EP2305652A2
139-EP2305654A1
139-EP2305655A2
139-EP2305657A2
139-EP2305658A1
139-EP2305659A1
139-EP2305660A1
139-EP2305662A1
139-EP2305663A1
139-EP2305664A1
139-EP2305666A1
139-EP2305667A2
139-EP2305668A1
139-EP2305669A1
139-EP2305671A1
139-EP2305672A1
139-EP2305673A1
139-EP2305674A1
139-EP2305675A1
139-EP2305676A1
139-EP2305677A1
139-EP2305678A1
139-EP2305679A1
139-EP2305680A2
139-EP2305681A1
139-EP2305682A1
139-EP2305683A1
139-EP2305684A1
139-EP2305685A1
139-EP2305686A1
139-EP2305687A1
139-EP2305688A1
139-EP2305695A2
139-EP2305696A2
139-EP2305697A2
139-EP2305698A2
139-EP2305769A2
139-EP2305808A1
139-EP2305825A1
139-EP2308471A1
139-EP2308479A2
139-EP2308492A1
139-EP2308509A1
139-EP2308510A1
139-EP2308562A2
139-EP2308812A2
139-EP2308828A2
139-EP2308832A1
139-EP2308833A2
139-EP2308838A1
139-EP2308839A1
139-EP2308840A1
139-EP2308841A2
139-EP2308842A1
139-EP2308848A1
139-EP2308849A1
139-EP2308850A1
139-EP2308851A1
139-EP2308852A1
139-EP2308853A1
139-EP2308854A1
139-EP2308855A1
139-EP2308857A1
139-EP2308858A1
139-EP2308861A1
139-EP2308863A1
139-EP2308864A1
139-EP2308865A1
139-EP2308866A1
139-EP2308867A2
139-EP2308868A1
139-EP2308869A1
139-EP2308870A2
139-EP2308871A1
139-EP2308872A1
139-EP2308873A1
139-EP2308874A1
139-EP2308875A1
139-EP2308876A1
139-EP2308877A1
139-EP2308878A2
139-EP2308879A1
139-EP2308880A1
139-EP2308882A1
139-EP2308883A1
139-EP2308926A1
139-EP2309505A1
139-EP2309564A1
139-EP2309584A1
139-EP2311451A1
139-EP2311453A1
139-EP2311455A1
139-EP2311464A1
139-EP2311494A1
139-EP2311796A1
139-EP2311797A1
139-EP2311798A1
139-EP2311799A1
139-EP2311801A1
139-EP2311802A1
139-EP2311803A1
139-EP2311805A1
139-EP2311806A2
139-EP2311807A1
139-EP2311808A1
139-EP2311810A1
139-EP2311811A1
139-EP2311812A1
139-EP2311814A1
139-EP2311815A1
139-EP2311816A1
139-EP2311817A1
139-EP2311818A1
139-EP2311820A1
139-EP2311821A1
139-EP2311822A1
139-EP2311823A1
139-EP2311824A1
139-EP2311825A1
139-EP2311826A2
139-EP2311827A1
139-EP2311828A1
139-EP2311829A1
139-EP2311830A1
139-EP2311831A1
139-EP2311832A1
139-EP2311833A1
139-EP2311834A1
139-EP2311835A1
139-EP2311836A1
139-EP2311837A1
139-EP2311838A1
139-EP2311839A1
139-EP2311840A1
139-EP2311842A2
139-EP2311850A1
139-EP2314295A1
139-EP2314298A1
139-EP2314558A1
139-EP2314571A2
139-EP2314575A1
139-EP2314576A1
139-EP2314577A1
139-EP2314578A1
139-EP2314579A1
139-EP2314581A1
139-EP2314582A1
139-EP2314583A1
139-EP2314584A1
139-EP2314585A1
139-EP2314586A1
139-EP2314587A1
139-EP2314588A1
139-EP2314589A1
139-EP2314590A1
139-EP2314591A1
139-EP2314593A1
139-EP2315303A1
139-EP2315502A1
139-EP2316450A1
139-EP2316452A1
139-EP2316457A1
139-EP2316458A1
139-EP2316459A1
139-EP2316470A2
139-EP2316825A1
139-EP2316826A1
139-EP2316827A1
139-EP2316828A1
139-EP2316829A1
139-EP2316830A2
139-EP2316831A1
139-EP2316832A1
139-EP2316833A1
139-EP2316835A1
139-EP2316836A1
139-EP2316837A1
139-EP2316905A1
139-EP2316906A2
139-EP2316937A1
139-EP2371797A1
139-EP2371798A1
139-EP2371800A1
139-EP2371806A1
139-EP2371807A1
139-EP2371810A1
139-EP2371811A2
139-EP2371813A1
139-EP2371814A1
139-EP2371823A1
139-EP2371831A1
139-EP2372017A1
139-EP2372804A1
139-EP2374454A1
139-EP2374538A1
139-EP2374780A1
139-EP2374781A1
139-EP2374783A1
139-EP2374788A1
139-EP2374790A1
139-EP2374791A1
139-EP2374792A1
139-EP2374895A1
139-EP2377510A1
139-EP2377841A1
139-EP2377845A1
139-EP2377847A1
139-EP2378585A1
139-EP2380568A1
139-EP2380872A1
139-EP2380873A1
139-EP2380874A2
2 Pack Assured Instant Hand Sanitizer With Moisturizers (vitamin E and Aloe) Lemon Scented
3 Pack Assured Instant Hand Sanitizer With Moisturizers (vitamin E and Aloe) Lemon Scented
Ethyl alcohol, Pure, 190 proof, meets USP testing specifications
Ethyl alcohol, Pure, 200 proof, meets USP testing specifications
SR-01000944357
Vida Mia Hand Sanitizer (70% V/v)
121182-78-3
Ethanol, absolute, for HPLC, >=99.8%
Ethyl Alcohol Absolute (Dehydrated) USP, BP/EP, JP Grade
Ethyl alcohol, Pure, 190 proof, for molecular biology
Ethyl alcohol, Pure, 200 proof, for molecular biology
SDM No. 37 (Salt/Mix)
Specially Denatured Alcohol, 190 proof, SDA 3C, contains Isopropanol
Specially Denatured Alcohol, 200 proof, SDA 3C, contains Isopropanol
1037-EP2269996A1
1037-EP2270002A1
1037-EP2270006A1
1037-EP2272848A1
1037-EP2274983A1
1037-EP2275411A2
1037-EP2277565A2
1037-EP2277566A2
1037-EP2277567A1
1037-EP2277568A2
1037-EP2277569A2
1037-EP2277570A2
1037-EP2277862A2
1037-EP2277866A1
1037-EP2277867A2
1037-EP2280003A2
1037-EP2280008A2
1037-EP2280010A2
1037-EP2281563A1
1037-EP2284160A1
1037-EP2284169A1
1037-EP2284172A1
1037-EP2287152A2
1037-EP2287160A1
1037-EP2287161A1
1037-EP2287162A1
1037-EP2289868A1
1037-EP2289893A1
1037-EP2292227A2
1037-EP2292280A1
1037-EP2295055A2
1037-EP2295402A2
1037-EP2295408A1
1037-EP2295410A1
1037-EP2295416A2
1037-EP2295437A1
1037-EP2295439A1
1037-EP2298734A2
1037-EP2298735A1
1037-EP2298748A2
1037-EP2298770A1
1037-EP2298775A1
1037-EP2301939A1
1037-EP2302382A2
1037-EP2302383A2
1037-EP2305243A1
1037-EP2305254A1
1037-EP2305679A1
1037-EP2305684A1
1037-EP2305689A1
1037-EP2308479A2
1037-EP2308861A1
1037-EP2308872A1
1037-EP2308873A1
1037-EP2308875A1
1037-EP2311453A1
1037-EP2311809A1
1037-EP2311814A1
1037-EP2311821A1
1037-EP2311824A1
1037-EP2311831A1
1037-EP2311832A1
1037-EP2311833A1
1037-EP2311837A1
1037-EP2311840A1
1037-EP2311842A2
1037-EP2314584A1
1037-EP2316459A1
1037-EP2316470A2
1037-EP2316829A1
1037-EP2316831A1
1037-EP2316832A1
1037-EP2316833A1
1037-EP2316834A1
1037-EP2316835A1
1037-EP2316836A1
1037-EP2374454A1
4260-EP2269977A2
4260-EP2269988A2
4260-EP2269996A1
4260-EP2270000A1
4260-EP2270001A1
4260-EP2270002A1
4260-EP2270003A1
4260-EP2270006A1
4260-EP2270008A1
4260-EP2270010A1
4260-EP2270011A1
4260-EP2270012A1
4260-EP2270013A1
4260-EP2270015A1
4260-EP2270018A1
4260-EP2272510A1
4260-EP2272825A2
4260-EP2272826A1
4260-EP2272839A1
4260-EP2272840A1
4260-EP2272848A1
4260-EP2275102A1
4260-EP2275412A1
4260-EP2275413A1
4260-EP2277848A1
4260-EP2277867A2
4260-EP2277874A1
4260-EP2277875A2
4260-EP2277877A1
4260-EP2279741A2
4260-EP2280003A2
4260-EP2280006A1
4260-EP2280008A2
4260-EP2280010A2
4260-EP2281563A1
4260-EP2281812A1
4260-EP2281813A1
4260-EP2281819A1
4260-EP2281822A1
4260-EP2281861A2
4260-EP2284157A1
4260-EP2284174A1
4260-EP2286811A1
4260-EP2287156A1
4260-EP2287159A1
4260-EP2287165A2
4260-EP2287166A2
4260-EP2287167A1
4260-EP2289509A2
4260-EP2289881A1
4260-EP2289883A1
4260-EP2289893A1
4260-EP2289894A2
4260-EP2292589A1
4260-EP2292593A2
4260-EP2292612A2
4260-EP2292617A1
4260-EP2292620A2
4260-EP2292628A2
4260-EP2295055A2
4260-EP2295401A2
4260-EP2295402A2
4260-EP2295409A1
4260-EP2295411A1
4260-EP2295412A1
4260-EP2295413A1
4260-EP2295416A2
4260-EP2295417A1
4260-EP2295426A1
4260-EP2295427A1
4260-EP2295428A2
4260-EP2295429A1
4260-EP2295432A1
4260-EP2295433A2
4260-EP2295435A1
4260-EP2295437A1
4260-EP2295441A2
4260-EP2295503A1
4260-EP2298312A1
4260-EP2298734A2
4260-EP2298735A1
4260-EP2298743A1
4260-EP2298744A2
4260-EP2298748A2
4260-EP2298750A1
4260-EP2298761A1
4260-EP2298762A2
4260-EP2298770A1
4260-EP2298775A1
4260-EP2298776A1
4260-EP2298780A1
4260-EP2301536A1
4260-EP2301538A1
4260-EP2301544A1
4260-EP2301627A1
4260-EP2301923A1
4260-EP2301928A1
4260-EP2301930A1
4260-EP2301934A1
4260-EP2301939A1
4260-EP2305250A1
4260-EP2305644A1
4260-EP2305648A1
4260-EP2305652A2
4260-EP2305660A1
4260-EP2305671A1
4260-EP2305676A1
4260-EP2305681A1
4260-EP2305682A1
4260-EP2305684A1
4260-EP2305687A1
4260-EP2305689A1
4260-EP2305695A2
4260-EP2305696A2
4260-EP2305697A2
4260-EP2305698A2
4260-EP2305769A2
4260-EP2305808A1
4260-EP2308833A2
4260-EP2308840A1
4260-EP2308841A2
4260-EP2308844A2
4260-EP2308845A2
4260-EP2308846A2
4260-EP2308848A1
4260-EP2308849A1
4260-EP2308850A1
4260-EP2308851A1
4260-EP2308852A1
4260-EP2308861A1
4260-EP2308867A2
4260-EP2308870A2
4260-EP2308872A1
4260-EP2308873A1
4260-EP2308875A1
4260-EP2308876A1
4260-EP2308879A1
4260-EP2311453A1
4260-EP2311455A1
4260-EP2311802A1
4260-EP2311803A1
4260-EP2311806A2
4260-EP2311807A1
4260-EP2311808A1
4260-EP2311821A1
4260-EP2311824A1
4260-EP2311825A1
4260-EP2311826A2
4260-EP2311829A1
4260-EP2311830A1
4260-EP2311831A1
4260-EP2311838A1
4260-EP2311840A1
4260-EP2311842A2
4260-EP2314295A1
4260-EP2314576A1
4260-EP2314586A1
4260-EP2314593A1
4260-EP2315502A1
4260-EP2316452A1
4260-EP2316824A1
4260-EP2316827A1
4260-EP2316829A1
4260-EP2316831A1
4260-EP2316835A1
4260-EP2316836A1
4260-EP2316905A1
4260-EP2316906A2
4260-EP2371813A1
4260-EP2374454A1
4260-EP2374790A1
4260-EP2377845A1
4260-EP2377849A2
4260-EP2380874A2
MolPort-001-785-844
Specially Denatured Alcohol, 190 proof, SDA 3A, contains Methanol
Specially Denatured Alcohol, 200 proof, SDA 3A, contains Methanol
Ethanol, 95.1-96.9%
Ethanol, absolute, >=99.8% (GC)
28147-EP2277868A1
28147-EP2277869A1
28147-EP2277870A1
28147-EP2295422A2
28147-EP2298305A1
28147-EP2298769A1
28147-EP2308852A1
28147-EP2308878A2
28147-EP2313400A1
28147-EP2371823A1
48516-EP2311824A1
48516-EP2311828A1
48516-EP2380568A1
Ethanol, p.a., 99.8%
Specially Denatured Alcohol, 190 proof, SDA 39C, contains Diethyl phthalate
Specially Denatured Alcohol, 200 proof, SDA 39C, contains Diethyl phthalate
Vida Mia Hand Sanitizer Aloe Vera (70% V/v)
Ethanol Fixative 80% v/v, suitable for fixing solution (blood films)
Ethanol, p.a., ACS reagent, 96%
Ethyl Alcohol Absolute (Dehydrated, Synthetic) USP, BP/EP, JP Grade
Specially Denatured Alcohol, 190 proof, SDA 23A, contains Acetone
Specially Denatured Alcohol, 190 proof, SDA 30, contains Methanol
Specially Denatured Alcohol, 200 proof, SDA 23A, contains Acetone
Specially Denatured Alcohol, 200 proof, SDA 30, contains Methanol
Specially Denatured Alcohol, 190 proof, SDA 35A, contains Ethyl acetate
Specially Denatured Alcohol, 200 proof, SDA 35A, contains Ethyl acetate
SR-01000944357-1
Ethanol, >10 - 24% in a non hazardous diluent
Ethanol, >24 - 50% in a non hazardous diluent
Ethanol, absolute, semiconductor grade PURANAL(TM) (Honeywell 17826)
Specially Denatured Alcohol, 190 proof, SDA 2B-4, contains Heptanes
Specially Denatured Alcohol, 200 proof, SDA 2B-4, contains Heptanes
Ethanol, technical grade, 92.6-93.8
Specially Denatured Alcohol, 190 proof, SDA 2B-3, contains Toluene
Specially Denatured Alcohol, 200 proof, SDA 2B-3, contains Toluene
Ethanol Calibration Kit, ampule of 10 x 1.2 mL, certified reference material
Ethanol, denatured (5 % IPA, 5 % n-propylacetate)
Ethanol, USP, 70.0-72.0%
Ethanol, USP, 94.9-96.0%
Specially Denatured Alcohol, 190 proof, SDA 40B, contains tert-Butyl alcohol and denatonium benzoate
Specially Denatured Alcohol, 200 proof, SDA 40B, contains tert-Butyl alcohol and denatonium benzoate
Ethanol, absolute, for gradient elution, sales not in Germany, >=99.9%
Ethanol, p.a., ACS reagent, 95.0%
ETHYL, 1-HYDROXY-(6CI,7CI,8CI,9CI)
ETHAN-2,2,2-D3-OL (9CI)
Ethanol, ACS reagent, 99.8, 200 proof
Ethanol, JIS special grade, 94.8-95.8%
Specially Denatured Alcohol, 190 proof, SDA 2B-4, contains n-Heptane
Specially Denatured Alcohol, 200 proof, SDA 2B-4, contains n-Heptane
Ethanol, 95.0%, (190 proof)
Ethanol, JIS first grade, 94.8-95.8%
Specially Denatured Alcohol, 190 proof, SDA 2B-5, contains n-Hexane
Specially Denatured Alcohol, 200 proof, SDA 2B-5, contains n-Hexane
Ethyl alcohol, Pure, 140 proof, Excise Tax-free, Permit for use required
Ethyl alcohol, Pure, 160 proof, Excise Tax-free, Permit for use required
Ethanol-water solutions, NIST(R) SRM(R) 1828b, six levels
Ethanol, absolute, >=99.8% (GC), sales not in Germany
Ethyl alcohol, Pure, 190 proof, ACS spectrophotometric grade, 95.0%
Ethyl alcohol, Pure, 200 proof, anhydrous, >=99.5%
InChI=1/C2H6O/c1-2-3/h3H,2H2,1H
Ethanol solution, EP, BP, 69.5-70.4%
Ethanol, suitable for 300 per JIS, >=99.5%, for residue analysis
Ethyl alcohol, Pure, 200 proof, ACS reagent, >=99.5%
Ethanol solution, NIST(R) SRM(R) 2897a, nominal mass fraction 2%
Ethanol solution, NIST(R) SRM(R) 2898a, nominal mass fraction 6%
Ethanol, suitable for 1000 per JIS, >=99.5%, for residue analysis
Ethyl alcohol, Pure, 140 proof, meets water USP testing specifications, Excise Tax-free, Permit for use required
Ethanol, puriss. p.a., absolute, >=99.8% (GC)
Ethanol solution, NIST(R) SRM(R) 2899a, nominal 25% by mass
Ethanol, absolute, for HPLC, sales not in Germany1, >=99.8% (GC)
Ethanol-water solution, NIST(R) SRM(R) 2894, nominal mass fraction 0.1%
Ethanol-water solution, NIST(R) SRM(R) 2895, nominal mass fraction 0.2%
Ethanol-water solution, NIST(R) SRM(R) 2896, nominal mass fraction 0.3%
Ethyl alcohol, Pure, 190 proof, ACS reagent, meets USP testing specifications, Excise Tax-free, Permit for use required
Ethyl alcohol, Pure, 200 proof, ACS reagent, meets USP testing specifications, Excise Tax-free, Permit for use required
Ethanol, puriss., meets analytical specification of Ph.??Eur., BP, 96% (v/v)
Ethanol-water solution, NIST(R) SRM(R) 2891, nominal mass fraction 0.02%
Ethanol-water solution, NIST(R) SRM(R) 2892, nominal mass fraction 0.04%
Ethanol-water solution, NIST(R) SRM(R) 2893, nominal mass fraction 0.08%
1E37B0D2-6209-4B03-A57D-500F3223C2DA
Ethanol-water solution, NIST(R) SRM(R) 2900, nominal 95.6% by mass
Ethanol, BioUltra, for molecular biology, >=99.8%, (absolute alcohol, without additive, A15 o1)
Ethanol, puriss., meets analytical specification of Ph.??Eur., BP, 96.0-97.2%
Ethanol standards 10% (v/v), 10 % (v/v) in H2O, analytical standard
Ethanol-80, 80 mg/dL in H2O, ampule of 5 x 5 mL, certified reference material
Ethanol, purum, absolute ethanol, denaturated with 1% cyclohexane, A15 CYCLO1, >=99.8% (based on denaturant-free substance)
Ethanol, purum, fine spirit, denaturated with 4.8% methanol, F25 METHYL1, ~96% (based on denaturant-free substance)
Ethanol, puriss. p.a., ACS reagent, prima fine spirit, without additive, F15 o1, ~96%
Ethanol, purum, fine spirit, denaturated with 2% 2-butanone, F25 MEK1, ~96% (based on denaturant-free substance)
Ethanol, puriss. p.a., ACS reagent, absolute alcohol, without additive, A15 o1, >=99.8%
Ethanol, purum, absolute ethanol, denaturated with 4.8% isopropanol, A15 IPA1, >=99.8% (based on denaturant-free substance)
Ethanol-25, 25 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-40, 40 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-50, 50 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-80, 80 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol, purum, absolute ethanol, denaturated with 2% 2-butanone, A15 MEK1, >=99.8% (based on denaturant-free substance)
Ethanol-10, 10 mg/dL in H2O, pack of 10 x 1.2 mL ampules, certified reference material
Ethanol-150, 150 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-300, 300 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-500, 500 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.9%
Ethanol, absolute, semiconductor grade PURANAL(TM) (Honeywell 17833), sales not in Germany, >=99.8% (vol.)
Ethanol-20 (5 ampules/kit), 20 mg/dL in H2O, ampule of 5 x 5 mL, certified reference material
Ethanol-100 (5 ampules/kit), 100 mg/dL in H2O, ampule of 5 x 5 mL, certified reference material
Ethanol-200 (5 ampules/kit), 200 mg/dL in H2O, ampule of 5 x 5 mL, certified reference material
Ethanol-400 (5 ampules/kit), 400 mg/dL in H2O, ampule of 5 x 5 mL, certified reference material
Ethanol, puriss., over molecular sieve (H2O <=0.01%), absolute alcohol, without additive, A15 o1, >=99.8%
Ethanol, absolute, reag. ISO, reag. Ph. Eur., >=99.8% (GC), liquid (clear, colorless)
Ethanol, purum, secunda spirit, denaturated with 2% 2-butanone and 0.5% 4-methyl-2-pentanone, S15, ~96% (based on denaturant-free substance)
Ethanol-20 (10 ampules/kit), 20 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-100 (10 ampules/kit), 100 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-200 (10 ampules/kit), 200 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Ethanol-400 (10 ampules/kit), 400 mg/dL in H2O, ampule of 10 x 1.2 mL, certified reference material
Specially Denatured Alcohol, 190 proof, SDA 40 (40-2), contains 0.14 % (v/v) tert-Butyl alcohol and Brucine sulfate
Specially Denatured Alcohol, 200 proof, SDA 40 (40-2), contains 0.14 % (v/v) tert-Butyl alcohol and Brucine sulfate
Ethanol, absolute, denaturated with 0.5-1.5 Vol.% 2-butanone and approx. 0.001% Bitrex (GC), >=98% (GC)
IUPAC nameethanol
SMILESCCO
InchiInChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
FormulaCH3CH2OH
PubChem ID702
Molweight46.069
LogP-0.16
Atoms9
Bonds8
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationAlcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for ethanol is 5X10-6 atm-cu m/mole(SRC)(1). This Henry's Law constant indicates that ethanol is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 5 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 39 days(SRC). Ethanol's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of ethanol from dry soil surfaces may exist(SRC) based upon an extrapolated vapor pressure of 59.3 mm Hg(3).
Literature: (1) Gaffney JS et al; Environ Sci Technol 21: 519-23 (1987) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation Washington, DC: Taylor and Francis (1989)
Soil Adsorption
A log Koc of 0.44 has been reported for ethanol(2), corresponding to a Koc of 2.75(SRC). According to a classification scheme(2), this estimated Koc value suggests that ethanol is expected to have very high mobility in soil. Ethanol leaching was measured using a shallow sand and gravel test aquifer in Merrick Co, central Platte Valley, Nebraska which was subjected to a pulse containing 220 mg/L ethanol and 12 mg/L bromide and monitored for 2.5 months. Transport was not retarded. An average first-order decay constant was estimated of be 0.32/day, corresponding to a half-life of 2.2 days(3). A sorption coefficient on a snow surface was reported as log K = -3.04 (cu m snow surface/sq m air) at -6.8 deg C(4).
Literature: (1) Schuurmann G et al; Environ Sci Technol 40: 7005-11 (2006) (2) Swann RL et al; Res Rev 85: 17-28 (1983) (3) Zhang Y et al; J Contam Hydrol 82: 183-194 (2006) (4) Roth CM et al; Environ Sci Technol 38: 4078-4084 (2004)
Vapor Pressure
PressureReference
59.3 mm Hg at 25 deg C /Extrapolated/Daubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber Aestivumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Borchiin/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Excavatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
BacteriaArthrobacter Agilis UMCV2narhizosphere of maize plantsVelázquez-Becerra et al.,2011
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaEnterobacter Cloacaen/aArnold and Senter, 1998
BacteriaEscherichia Colin/aBunge et al., 2008
BacteriaKlebsiella Pneumoniaen/aArnold and Senter, 1998
BacteriaL Isteria Monocytogenesn/aArnold and Senter, 1998
BacteriaLactobacillus Fermentum LSL 205nanaPogačić et al., 2016
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaPseudomonas Simiae AUnarhizosphere of a soybean field in the province of Rajasthan, IndiaVaishnav et al., 2016
BacteriaSalmonella Enterican/aBunge et al., 2008
BacteriaSalmonella Enteritidisn/aArnold and Senter, 1998
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaShigella Flexnerin/aBunge et al., 2008
BacteriaStaphylococcus Aureusn/aJia et al., 2010
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
FungiAerobasidium PullulansInhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiAscocoryne Sarcoides NRRL 50072n/aMallette et al. 2012
FungiAspergillus Fumigatus Strain FGSC A1163Heddergott et al. 2014
FungiBoletus VariegatusInhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiCandida Shehataecacti, fruits, insects, natural habitatsNout and Bartelt 1998
FungiCandida Tropicalisn/aBunge et al., 2008
Fungi Ceratocystis FagacearumLin and Phelan 1992
FungiCeratocystis Sp.Inhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiFomes Sp.Inhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiFusarium SpPierce et al. 1991
FungiMuscodor Albus CZ-620n/aCorcuff et al., 2011
FungiMuscodor Crispansn/aMitchell et al., 2010
FungiNeurospora Sitophila ATCC 46892n/aPastore et al.,1994
FungiNeurospora Sp.n/aPastore et al., 1994
FungiOgataea Pininamycangia of Dendroctonus brevicomisDavis et al., 2011
FungiPenicillium Aurantiogriseumn/aBoerjesson et al., 1990
Fungi Penicillium CamembertiLarsen 1998
Fungi Penicillium CaseifulvumLarsen 1998
FungiPenicillium CorymbiferumPierce et al. 1991
FungiPhoma Sp.n/aStrobel et al., 2014
FungiSaccharomyces CerevisiaeInhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiSaccharomyces Cerevisiae CR1control citrus black spot disease fermentation processesToffano et al. 2017
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiScolulariopsis BrevicaulisPierce et al. 1991
FungiThielaviopsis BasicolaInhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiTrichodema Pseudokoningiin/aWheatley et al., 1997
FungiTrichodema Viriden/aWheatley et al., 1997
FungiTrichoderma Sp.Inhibited growth of fungi( Aspergillus niger). Has no effect on bacteria. Stimulation of rhizomorph production of Armillaria mellea.Stotzky and Schenk, 1976
FungiTrichoderma Viriden/aHung et al., 2013
FungiTuber SimoneaNoneNone March et al., 2006
FungiTuber Aestivumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Simonean/aAyme Truffe of Grignan, 26230 France March et al., 2006
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
BacteriaArthrobacter Agilis UMCV2LB mediumSPME-GC/MSNo
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaClostridium Sp.n/an/a
BacteriaEnterobacter CloacaeHS-SPME/GC-MS
BacteriaEscherichia Colin/an/a
BacteriaKlebsiella PneumoniaeTS brothHS-SPME/GC-MS
BacteriaL Isteria MonocytogenesHS-SPME/GC-MS
BacteriaLactobacillus Fermentum LSL 205curd-based broth mediumGC/MSYes
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaPseudomonas Simiae AUNutrient broth; King's B agarGC/MSNo
BacteriaSalmonella Enterican/an/a
BacteriaSalmonella EnteritidisHS-SPME/GC-MS
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaShigella Flexnerin/an/a
BacteriaStaphylococcus AureusMueller Hinton brothHS-SPME/GC-MS
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
FungiAerobasidium Pullulansn/an/a
FungiAscocoryne Sarcoides NRRL 50072Minimal mediumPTR-MS and SPME GC-MS
FungiAspergillus Fumigatus Strain FGSC A1163Brian`s broth, AMM, RPMI 1657SPME / GC-MS
FungiBoletus Variegatusn/an/a
FungiCandida Shehataeyeast malt agarSPME, GC-MSyes
FungiCandida Tropicalisn/an/a
Fungi Ceratocystis Fagacearumno
FungiCeratocystis Sp.n/an/a
FungiFomes Sp.n/an/a
FungiFusarium SpGC-FIDyes
FungiMuscodor Albus CZ-620n/aHeadspace sampler/GC-MS
FungiMuscodor Crispanspotato dextrose agarSPME-GC-MS
FungiNeurospora Sitophila ATCC 46892Malt extractHeadspace/gas chromatography
FungiNeurospora Sp.potato dextrose agardynamic headspace/gas chromatography
FungiOgataea PiniMEAGC/MS
FungiPenicillium Aurantiogriseumn/an/a
Fungi Penicillium Camembertino
Fungi Penicillium Caseifulvumno
FungiPenicillium CorymbiferumGC-FIDyes
FungiPhoma Sp.n/aSolid phase microextraction (SPME)
FungiSaccharomyces Cerevisiaen/an/a
FungiSaccharomyces Cerevisiae CR1YEPDAGC/MSno
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiScolulariopsis BrevicaulisGC-FIDyes
FungiThielaviopsis Basicolan/an/a
FungiTrichodema PseudokoningiiMalt extract/Low mediumGC/MS
FungiTrichodema VirideMalt extract/Low mediumGC/MS
FungiTrichoderma Sp.n/an/a
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MS
FungiTuber SimoneaNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MS


Phthalic Acid

Mass-Spectra

Compound Details

Synonymous names
BENZENEDICARBOXYLICACID
Naphthalinate
o-Benzenedicarboxylate
PHTHALICACID
Alizarinate
Phthalinate
Naphthalinic acid
o-benzenedicarboxylic acid
o-Carboxybenzoate
o-dicarboxybenzene
Orthophthalic acid
XNGIFLGASWRNHJ-UHFFFAOYSA-N
Acide phtalique
Alizarinic acid
Kyselina ftalova
Phthalinic acid
phthals
Pathalic acid
phthalic acid
o-Carboxybenzoic acid
Pathalc acd
phthalsäure
ortho-phthalic acid
4kww
AC1L1AJQ
AC1Q1HCJ
Phthalate standard for IC
Phthalic acid, analytical standard
o-phthalic acid
1,2-benzenedicarboxylic acid
3,4-benzenedicarboxylic acid
CHEMBL1045
PHTHALIC ACID, ACS
SCHEMBL1808
Sunftal 20
Acide phtalique [French]
Kyselina ftalova [Czech]
s164
ACMC-209qya
NSC5348
6O7F7IX66E
H2983
HMDB02107
P0287
WLN: QVR BVQ
ZINC90750
benzene-1,2-dicarboxylic acid
DB02746
Phthalic acid, ~99%
RP22870
bmse000391
C01606
CCRIS 1446
HMS3039E17
HMS3604J03
HSDB 1339
Phthalic acid, European Pharmacopoeia (EP) Reference Standard
UNII-6O7F7IX66E
AK116685
BBL023724
DTXSID8021484
LS-1890
NSC 5348
NSC-5348
OR025173
OR183112
OR253495
OR331083
SBB058481
STL168879
benzene-1,2-dioic acid
CHEBI:29069
DSSTox_CID_1484
Phthalic acid, United States Pharmacopeia (USP) Reference Standard
AB1002491
AC-14464
AJ-10847
AN-20569
AN-24158
ANW-39200
BP-21159
DSSTox_GSID_21484
KB-59631
SC-67693
SC-74953
BDBM50080272
DSSTox_RID_76178
MFCD00002467
PHTHALIC ACID (CARBOXYL-13C)
AI3-02409
RTR-027988
ST24031536
ST50192167
AKOS000118898
I01-7091
J-523870
Phthalic acid, 99.5%
Phthalic acid, reagent grade, 98%
Z57127456
BRN 0608199
FT-0622644
MLS002152931
SMR001224528
88-99-3
1,2-Propylene glycol, bis(isooctyl phthalate)
Tox21_200915
3B1-008717
F3110-2832
CAS-88-99-3
4401-64-3
MCULE-4747891013
NCGC00090869-01
NCGC00090869-02
NCGC00258469-01
Phthalic acid, ACS reagent, >=99.5%
EINECS 201-873-2
Phthalic acid, SAJ special grade, >=99.0%
Phthalic acid, SAJ first grade, >=99.0%
Phthalic acid, Vetec(TM) reagent grade, 98%
1,2-Benzenedicarboxylic acid, 1-methyl-1,2-ethanediyl diisooctyl ester
MolPort-000-690-820
21176-EP2269988A2
21176-EP2270008A1
21176-EP2275413A1
21176-EP2284165A1
21176-EP2284178A2
21176-EP2284179A2
21176-EP2287156A1
21176-EP2292597A1
21176-EP2292617A1
21176-EP2295406A1
21176-EP2295438A1
21176-EP2298731A1
21176-EP2301924A1
21176-EP2301940A1
21176-EP2305219A1
21176-EP2305248A1
21176-EP2305663A1
21176-EP2305672A1
21176-EP2311807A1
21176-EP2311815A1
21176-EP2311824A1
21176-EP2314295A1
21176-EP2371805A1
21176-EP2374780A1
21176-EP2374781A1
21176-EP2374895A1
AB-131/40237186
827-27-0 (mono-hydrochloride salt)
10197-71-4 (hydrochloride salt)
877-24-7 (mono-potassium salt)
29801-94-3 (potassium salt)
15968-01-1 (di-hydrochloride salt)
4409-98-7 (di-potassium salt)
5793-85-1 (mono-calcium salt)
15656-86-7 (mono-barium salt)
33227-10-0 (mono-Ru salt)
4-09-00-03167 (Beilstein Handbook Reference)
Phthalic acid, ACS, 99.5% min. 100g
Phthalic acid, puriss. p.a., >=99.5% (T)
6838-85-3 (mono-lead(2+) salt)
InChI=1/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12
IUPAC namephthalic acid
SMILESC1=CC=C(C(=C1)C(=O)O)C(=O)O
InchiInChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)
FormulaC6H4(COOH)2
PubChem ID1017
Molweight166.132
LogP1.29
Atoms18
Bonds18
H-bond Acceptor4
H-bond Donor2
Chemical ClassificationBenzenoids Acids carboxylic acids

mVOC Specific Details

Volatilization
The Henry's Law constant for phthalic acid is estimated as 2X10-11 atm-cu m/mole(SRC) derived from its vapor pressure, 6.36X10-7 mm Hg(1), and water solubility, 6965 mg/L(2). This Henry's Law constant indicates that phthalic acid is expected to be essentially nonvolatile from water surfaces(3). Phthalic acid's Henry's Law constant indicates that volatilization from moist soil surfaces will not occur(SRC). Phthalic acid is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Physical And Thermodynamic Properties of Pure Chemicals: Data Compilation, Supplement 1 (1991) (2) Yalkowsky SH, He Y; Handbook of Aqueous Solubility Data. CRC Press LLC, Boca Raton, FL. p. 456 (2003) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
The Koc values were determined for an acidic forest soil (Podzol, 4.85% organic carbon, pH 2.8), an agricultural soil (Alfisol, 1.25% organic carbon, pH 6.7) and a sublimnic soil (sediment from Lake Constance, Germany, 1.58% organic carbon, pH 7.1) as 31, 2 and 2, respectively(1). According to a classification scheme(2), these Koc values suggest that phthalic acid is expected to have very high mobility in soil. Phthalic acid adsorbs strongly to aluminum and iron oxides via a surface ligand exchange reaction(3). Adsorptivity is sensitive to pH; for aluminum oxide the fraction absorbed is >0.8 below pH 6 and falls below 0.1 above pH 7.5(3).
Literature: (1) Von Oepen B et al; Chemosphere 22: 285-304 (1991) (2) Swann RL et al; Res Rev 85: 23 (1983) (3) Ainsworth CC et al; pp 125-44 in Sorption and Degradation of Pesticides in Soil Sci Soc Spec Publ 32 (1993)
Vapor Pressure
PressureReference
6.36X10-7 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaPseudomonas Putida BP25nablack pepper rootSheoran et al., 2015
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiLentinula EdodesnanaÇağlarırmak et al., 2007
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
N/aMarine Streptomycete (isolate B6007)n/aStritzke et al., 2004
BacteriaPseudomonas Simiae AUnarhizosphere of a soybean field in the province of Rajasthan, IndiaVaishnav et al., 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaPseudomonas Putida BP25Luria Bertani AgarSolvent extraction with hexane, GC/MSNo
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
FungiLentinula EdodesnaGC/MSNo
FungiSaccharomyces Cerevisiae Y1001n/an/a
N/aMarine Streptomycete (isolate B6007)n/an/a
BacteriaPseudomonas Simiae AUNutrient broth; King's B agarGC/MSNo


2-methylpropan-1-ol

Mass-Spectra

Compound Details

Synonymous names
Isopropylcarbinol
isobutylalcohol
Isobutylalkohol
Alcool isobutylique
Isobutanol
1-Hydroxymethylpropane
Fermentation butyl alcohol
Isobutanol, Spectrophotometric Grade
Isobutyl alcohol|
ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
ISOBUTYL ALCOHOL
NATURAL ISOBUTYL ALCOHOL
2-methylpropanoI
2-Methylpropanol
Butanol-iso
IBl
iso butanol
iso-butanol
Isobutanol or isobutyl alcohol
i-Butanol
Isobutyl Alcohol Reagent ACS
2-Methylpropyl alcohol
5OZ
AC1L1MSV
AC1Q1PQD
Iso-butyl alcohol
i-Butyl alcohol
Isobutylalkohol [Czech]
2-Methyl propanol
2-methyl-propanol
Isobutanol, HPLC Grade
Alcool isobutylique [French]
2-Methylpropanol-1
iso-C4H9OH
Isobutyl alcohol (natural)
HSDB 49
Isobutyl Alcohol (Fragrance Grade)
KSC377G2F
UNII-WB09NY83YA component ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
2-methyl-l-propanol
ACMC-209pff
NSC5708
UN1212
56F9Z98TEM
CTK2H7322
HMDB06006
I0094
Z1849
2-Methyl-1-propanol
2-Methylpropan-1-ol
ACT03408
BIDD:ER0628
CHEMBL269630
Methyl-2 propanol-1
RL05045
2-methyl-1-propanyl alcohol
C14710
CCRIS 2300
LTBB002055
RCRA waste number U140
UNII-56F9Z98TEM
DTXSID0021759
FEMA Number 2179
LS-1756
NSC 5708
NSC-5708
OR000149
OR250242
OR328314
Propanol, 2-methyl-
UN 1212
WLN: Q1Y1&1
2-Methyl-1-propanol, analytical standard
CHEBI:46645
DSSTox_CID_1759
PROPOXY, 2-METHYL-
ZINC1687155
2-methyl-propan-1-ol
AN-42121
ANW-37225
CJ-27908
DSSTox_GSID_21759
KB-25207
TRA0023784
DSSTox_RID_76310
LMFA05000100
MFCD00004740
ZINC01687155
AI3-01777
RTR-025160
TR-025160
AKOS000118740
J-509912
RCRA waste no. U140
1-Propanol, 2-methyl-
BRN 1730878
FEMA No. 2179
FT-0627343
78-83-1
I14-19788
Z955123524
Tox21_201214
Alcohols, C8-13-iso-
F0001-2058
Isobutyl alcohol, ACS reagent, >=99.0%
2-Methyl-1-propanol, 99%
CAS-78-83-1
Isobutyl alcohol, >=99%, FCC, FG
MCULE-6294327194
NCGC00091851-01
NCGC00091851-02
NCGC00258766-01
2-Methyl-1-propanol, United States Pharmacopeia (USP) Reference Standard
EINECS 201-148-0
EINECS 273-552-5
68989-27-5
821-EP2269986A1
821-EP2274983A1
821-EP2284157A1
821-EP2287152A2
821-EP2305825A1
821-EP2308857A1
821-EP2380568A1
Isobutyl alcohol, natural, >=99%, FCC, FG
Isobutanol or isobutyl alcohol [UN1212] [Flammable liquid]
2-Methyl-1-propanol, 99.5%
2-Methyl-1-propanol, LR, >=99%
MolPort-001-785-833
2-Methyl-1-propanol, AR, 99%
2-Methyl-1-propanol, ACS spectrophotometric grade, >=99.0%
28287-EP2270012A1
28287-EP2270013A1
28287-EP2272849A1
28287-EP2275423A1
28287-EP2280005A1
28287-EP2289509A2
28287-EP2289884A1
28287-EP2289892A1
28287-EP2292576A2
28287-EP2292613A1
28287-EP2295424A1
28287-EP2298313A1
28287-EP2298751A2
28287-EP2301919A1
28287-EP2305033A1
28287-EP2305254A1
28287-EP2305625A1
28287-EP2305647A1
28287-EP2305681A1
28287-EP2305825A1
28287-EP2308849A1
28287-EP2308850A1
28287-EP2308864A1
28287-EP2311801A1
28287-EP2311802A1
28287-EP2311803A1
28287-EP2311821A1
28287-EP2311838A1
28287-EP2314577A1
28287-EP2371814A1
28287-EP2374780A1
28287-EP2374781A1
28287-EP2377844A2
45218-EP2292616A1
45218-EP2311821A1
74956-EP2275411A2
74956-EP2275414A1
74956-EP2281821A1
74956-EP2298763A1
74956-EP2305254A1
74956-EP2305667A2
74956-EP2308838A1
74956-EP2374780A1
74956-EP2374781A1
2-Methyl-1-propanol, anhydrous, 99.5%
Isobutanol or isobutyl alcohol [UN1212] [Flammable liquid]
13259-29-5 (hydrochloride salt)
3453-79-0 (aluminum salt)
2-Methyl-1-propanol, ACS reagent, >=99.0%
2-Methyl-1-propanol, JIS special grade, >=99.0%
2-Methyl-1-propanol, for HPLC, 99.5%
2-Methyl-1-propanol, SAJ first grade, >=99.0%
4-01-00-01588 (Beilstein Handbook Reference)
Isobutanol, ACS, 99.0% min. 500ml
2-Methyl-1-propanol, reag. ISO, 99%, UV HPLC spectroscopic
7425-80-1 (titanium(+4) salt)
2-Methyl-1-propanol, BioUltra, for molecular biology, >=99.5% (GC)
2-Methyl-1-propanol, p.a., ACS reagent, 99.0%
2-Methyl-1-propanol, puriss. p.a., ACS reagent, >=99.5% (GC)
InChI=1/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H
2-Methyl-1-propanol, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99% (GC)
IUPAC name2-methylpropan-1-ol
SMILESCC(C)CO
InchiInChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
Formula(CH3)2CHCH2OH
PubChem ID6560
Molweight74.123
LogP0.73
Atoms15
Bonds14
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationAlcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for isobutyl alcohol is 9.78X10-6 atm-cu m/mole(1). This Henry's Law constant indicates that isobutyl alcohol is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3.3 days(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 27 days(SRC). Isobutyl alcohol's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). Isobutyl alcohol is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 10.4 mm Hg at 25 deg C(3).
Literature: (1) Snider JR, Dawson; J Geophys Res 90: 3797-3805 (1985) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation Washington, DC: Taylor and Francis (1989)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of isobutyl alcohol can be estimated to be 2.9(SRC). According to a classification scheme(2), this estimated Koc value suggests that isobutyl alcohol is expected to have very high mobility in soil.
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.11. Nov, 2012. Available from, as of June 10, 2014: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
10.4 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
FungiTuber SimoneaNoneNone March et al., 2006
FungiTuber Aestivumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Simonean/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiAscocoryne Sarcoides NRRL 50072n/aMallette et al. 2012
FungiMuscodor Albus CZ-620n/aCorcuff et al., 2011
FungiMuscodor CrispansWild pineapple plant, Ananas ananassoidesMitchell et al., 2010
FungiPhoma Sp.n/aStrobel et al., 2014
FungiPhomopsis Sp.naendophyte of Odontoglossum sp.Singh et al., 2011
FungiPenicillium Glabrumcompost Fischer et al. 2054
BacteriaEnterobacter Cloacae SM 639naubiquitary,intestinalSchoeller et al., 1997
BacteriaMycobacterium Bovisn/aMCNerney et al., 2014
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStreptomyces Albidoflavus AMI 246n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticus CBS 659.68n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticus ETH 22014n/aSchoeller et al., 2002
BacteriaStreptomyces Aureofaciens ETH 13387n/aSchoeller et al., 2002
BacteriaStreptomyces Aureofaciens ETH 28832n/aSchoeller et al., 2002
BacteriaStreptomyces Coelicolor ATCC 21666n/aSchoeller et al., 2002
BacteriaStreptomyces Coelicolor DSM 40233n/aSchoeller et al., 2002
BacteriaStreptomyces Diastatochromogenes ETH 18822n/aSchoeller et al., 2002
BacteriaStreptomyces Diastatochromogenes IFO 13814n/aSchoeller et al., 2002
BacteriaStreptomyces Griseus ATCC 23345n/aSchoeller et al., 2002
BacteriaStreptomyces Griseus IFO 13849n/aSchoeller et al., 2002
BacteriaStreptomyces Hirsutus ETH 1666n/aSchoeller et al., 2002
BacteriaStreptomyces Murinus NRRL 8171n/aSchoeller et al., 2002
BacteriaStreptomyces Olivaceus ETH 6445n/aSchoeller et al., 2002
BacteriaStreptomyces Olivaceus ETH 7437n/aSchoeller et al., 2002
BacteriaStreptomyces Rishiriensis AMI 224n/aSchoeller et al., 2002
BacteriaStreptomyces Thermoviolaceus CBS 111.62n/aSchoeller et al., 2002
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
BacteriaThermomonospora Fusca DSM 43792nasoilWilkins, 1996
FungiAspergillus Candiduscompost Fischer et al. 2054
FungiAspergillus Versicolor Tiraboschinadamp indoor environments, food productsSunesson et al., 1995
FungiCandida Shehataecacti, fruits, insects, natural habitatsNout and Bartelt 1998
FungiGeotrichium CandidumSchnürer et al. 1999
FungiMortierella Isabellinamor horizon of a spruce forest soil southeastern SwedenBengtsson et al 1991
FungiPaecilomyces Variotiicompost Fischer et al. 2054
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
FungiPenicillium Aurantiogriseumn/aBoerjesson et al., 1990
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPenicillium RoquefortiSchnürer et al. 1999
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiRhizoctonia Solani AG2-2 IIIBcollection of the Sugar Beet Research Institute, Bergen op Zoom, The NetherlandsCordovez et al. 2017
FungiSaccharomyces Cerevisiaegrape vineBecher et al. 2012
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTrichodema Pseudokoningiin/aWheatley et al., 1997
FungiTrichodema Viriden/aWheatley et al., 1997
FungiTuber Aestivumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Borchiin/aProf. MattiaProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata region Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Excavatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Indicumn/aSplivallo et al., 2007
FungiTuber Melanosporumn/aSplivallo et al., 2007
FungiXylaria Sp.phytotoxic on the seed germination, root elongation and seedling respiration of Am. Hypochondriacus and S. lycopersicumHaematoxylon brasiletto, Morelos, MexicoSánchez-Ortiz et al., 2016
FungiGeotrichum Candidumcompost mixed with milky fermented productZirbes et al. 2012
FungiAmpelomyces Sp. F-a-3nanaNaznin et al., 2014
FungiPhoma Sp. GS8-3nanaNaznin et al., 2014
BacteriaActinomycetes Spp.n/aSchulz and Dickschat, 2007
BacteriaLeuconostoc Lactis CIRM1451nacow cheesePogačić et al., 2016
FungiAspergillus Fumigatuscompost Fischer et al. 2054
FungiEmericella Nidulanscompost Fischer et al. 2054
FungiPenicillium Brevicompactumcompost Fischer et al. 2054
FungiPenicillium Clavigerumcompost Fischer et al. 2054
FungiPenicillium Crustosumcompost Fischer et al. 2054
FungiPenicillium Cyclopiumcompost Fischer et al. 2054
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaLactobacillus Casei NCIB 8010n/aTracey and Britz, 1989
BacteriaLactobacillus Plantarum NCIB 6376n/aTracey and Britz, 1989
BacteriaLactococcus Lactis DSM 20202n/aTracey and Britz, 1989
BacteriaLeuconostoc Cremoris DSM 20346n/aTracey and Britz, 1989
BacteriaLeuconostoc Dextranicum DSM 20484n/aTracey and Britz, 1989
BacteriaLeuconostoc Mesenteroides DSM 20343n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos B66n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 19n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 30n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 36n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 37Dn/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos 7Bn/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20252n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20255n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos DSM 20257n/aTracey and Britz, 1989
BacteriaLeuconostoc Oenos Lc5xn/aTracey and Britz, 1989
BacteriaLeuconostoc Paramesenteroides DSM 20288n/aTracey and Britz, 1989
BacteriaPediococcus Damnosus DSM 20331n/aTracey and Britz, 1989
FungiAlternaria Alternata(Fr.)Keissler (DSMZ 62006) Coculture With Fusarium Oxysporum F. Aechmeae(Fr.)Schltdl. (DSMZ 62297)DSMZWeikl et al. 2016
FungiBoletus VariegatusInhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
Fungi Chalaropsis ThielaviodesCollins 1960
FungiFomes Sp.Inhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiSaccharomyces CerevisiaeInhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiVerticillium Longisporumcollection TU GrazRybakova et al. 2017
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
FungiTuber SimoneaNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MS
FungiAscocoryne Sarcoides NRRL 50072Minimal mediumPTR-MS and SPME GC-MS
FungiMuscodor Albus CZ-620n/aHeadspace sampler/GC-MS
FungiMuscodor Crispanspotato dextrose agarSPME-GC-MSYes
FungiPhoma Sp.n/aSolid phase microextraction (SPME)
FungiPhomopsis Sp.PDA mediumSPME-GC/MSYes
FungiPenicillium Glabrumyest extract sucroseTenax/GC-MSno
BacteriaEnterobacter Cloacae SM 639AB medium + 1% citrateGC-FID,GC/MS
BacteriaMycobacterium BovisLoewenstein-Jensen mediaHeadspace analyze / SIFT-MS and TD-GC-MS.
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStreptomyces Albidoflavus AMI 246Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Antibioticus CBS 659.68Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Antibioticus ETH 22014Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Aureofaciens ETH 13387Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Aureofaciens ETH 28832Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Coelicolor ATCC 21666Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Coelicolor DSM 40233Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Diastatochromogenes ETH 18822Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Diastatochromogenes IFO 13814Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Griseus ATCC 23345Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Griseus IFO 13849Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Hirsutus ETH 1666Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Murinus NRRL 8171Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Olivaceus ETH 6445Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Olivaceus ETH 7437Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Rishiriensis AMI 224Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Thermoviolaceus CBS 111.62Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
BacteriaThermomonospora Fusca DSM 43792Nutrient agar CM3GC/MS
FungiAspergillus Candidusyest extract sucroseTenax/GC-MSno
FungiAspergillus Versicolor TiraboschiDG18GC/MS
FungiCandida Shehataeyeast malt agarSPME, GC-MSyes
FungiGeotrichium Candidummalt extract agar with 0.5-1.0% acetic acid,Aspergillus flavus and parasiticus agar (AFPA),dichloran rose bengal yeast extract sucrose agar (DRYES)TenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiMortierella Isabellinamalt extact agardiethyl extraction, GC-MSno
FungiPaecilomyces Variotiiyest extract sucroseTenax/GC-MSno
FungiPaecilomyces Variotii BainDG18,MEAGC/MS
FungiPenicillium Aurantiogriseumn/an/a
FungiPenicillium Commune PittDG18GC/MS
FungiPenicillium Roquefortimalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiRhizoctonia Solani AG2-2 IIIBPotato Dextrose Agar1Tenax TA / TDGC-MSyes
FungiSaccharomyces Cerevisiaesynthetic minimal mediumGC-MS, EIyes
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTrichodema PseudokoningiiMalt extract/Low mediumGC/MS
FungiTrichodema VirideLow mediumGC/MS
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Indicumn/an/a
FungiTuber Melanosporumn/an/a
FungiXylaria Sp.PDA mediumSPME-GC/MSYes
FungiGeotrichum Candidummedium 863SPME-GC-MSyes
FungiAmpelomyces Sp. F-a-3naSPME-GC/MSNo
FungiPhoma Sp. GS8-3naSPME-GC/MSNo
BacteriaActinomycetes Spp.n/an/a
BacteriaLeuconostoc Lactis CIRM1451curd-based broth mediumGC/MSYes
FungiAspergillus Fumigatusyest extract sucroseTenax/GC-MSno
FungiEmericella Nidulansyest extract sucroseTenax/GC-MSno
FungiPenicillium Brevicompactumyest extract sucroseTenax/GC-MSno
FungiPenicillium Clavigerumyest extract sucroseTenax/GC-MSno
FungiPenicillium Crustosumyest extract sucroseTenax/GC-MSno
FungiPenicillium Cyclopiumyest extract sucroseTenax/GC-MSno
BacteriaClostridium Sp.n/an/a
BacteriaLactobacillus Casei NCIB 8010n/an/a
BacteriaLactobacillus Plantarum NCIB 6376n/an/a
BacteriaLactococcus Lactis DSM 20202n/an/a
BacteriaLeuconostoc Cremoris DSM 20346n/an/a
BacteriaLeuconostoc Dextranicum DSM 20484n/an/a
BacteriaLeuconostoc Mesenteroides DSM 20343n/an/a
BacteriaLeuconostoc Oenos B66n/an/a
BacteriaLeuconostoc Oenos 19n/an/a
BacteriaLeuconostoc Oenos 30n/an/a
BacteriaLeuconostoc Oenos 36n/an/a
BacteriaLeuconostoc Oenos 37Dn/an/a
BacteriaLeuconostoc Oenos 7Bn/an/a
BacteriaLeuconostoc Oenos DSM 20252n/an/a
BacteriaLeuconostoc Oenos DSM 20255n/an/a
BacteriaLeuconostoc Oenos DSM 20257n/an/a
BacteriaLeuconostoc Oenos Lc5xn/an/a
BacteriaLeuconostoc Paramesenteroides DSM 20288n/an/a
BacteriaPediococcus Damnosus DSM 20331n/an/a
FungiAlternaria Alternata(Fr.)Keissler (DSMZ 62006) Coculture With Fusarium Oxysporum F. Aechmeae(Fr.)Schltdl. (DSMZ 62297)malt extract agarSBSE-GC-MSno
FungiBoletus Variegatusn/an/a
Fungi Chalaropsis Thielaviodesno
FungiFomes Sp.n/an/a
FungiSaccharomyces Cerevisiaen/an/a
FungiVerticillium Longisporumpotato dextrose agar (PDA), Czapek Dox liquid cultureGC-MS / SPMEno


Propan-2-ol

Mass-Spectra

Compound Details

Synonymous names
Dimethylcarbinol
Germstaroriginal
isopropylalcohol
Isopropylalkohol
Recovered Isopropanol
Agropharma Isopropyl Alcohol
Alcool isopropilico
Alcool isopropylique
isopropanol
Isopropenol
Isopropyl Alcohol Antiseptic
Isopropyl Alcohol Antiseptic Germicide
Isopropyl Alcohol Swabsticks
Medichoice Alcohol Swabstick
Takineocol
Wintergreen Isopropyl Alcohol
Alcohol Swabstick
Alcohol Swabsticks Singles
Alcosolve
Alkolave
Aplicare Isopropyl Alcohol
Avantine
Divas Wintergreen
Germstar Original Unscented
Goodsense Alcohol
Hartosol
Incontrol Alcohol
iso-propylalcohol
Iso-propylalkohol
Isopropryl alcohol
isopropyl
Isopropyl alcohol
Isopropyl Alcohol Swabstick Sterile
Isopropyl Alcohol Towelette
Isopropyl-alcohol
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Medimaxx
Petrohol
Spectrar
Sterisol hand disinfectant
Acetone Alcohol Swabsticks Singles
acetone isopropyl alcohol
Alcohol Sterile
Alcojel
Alcolo
Antiseptic Swab
Avantin
Comfort
Freshnails The Undernail Sanitizer
Healthcare Plus
i-propylalcohol
i-Propylalkohol
Isohol
Isopropyl Alcohol With Wintergreen
Isopropyl Rubbing Alcohol
Isopropyl Rubbing Alcohol With Wintergreen
Lavaco
Lavacol
Lutosol
Medline Alcohol Swabstick Triples
Propol
Rubbing alcohol
Sterile Alcohol
Sunmark Isopropyl Rubbing Alcohol
Tinted Isopropyl Alcohol
Virahol
Walgreen Alcohol
2propanol
Alcohol Hand Sanitizer Problend
Alcool Isopropylique A Friction
Allure Isopropyl Rubbing Alcohol
Allure Isopropyl Rubbing Alcohol With Wintergreen
Curad Isopropyl Alcohol
Divas
Family Wellness Sterile Alcohol
Handy Solutions Rubbing Alcohol
iPrOH
Iris
Isopropanol ACS reagent
Isopropanol or isopropyl alcohol
Isopropyl Alcohol Sepp
Isopropyl Alcohol Surgical Scrub
Isopropyl Alcohol Swabs
Jianze Alcohol
Medichoice Antiseptic Isopropyl Alcohol Prep Pads
Paraid Alcohol
Procutane Gel
Publix Alcohol
Starcap Medical Private Limited
Wearable Dispenser Cartridge Scs
2-Hydroxypropane
Alcohol Hand Problend
Alcohol Pad
Alcohol Prep
Alcohol Rub
Alcohol Wipe
Arquad DMCB
Assured Alcohol Cleansing Pad
Cardinalhealth Alcohol Prep Pads Large
Cardinalhealth Alcohol Prep Pads Medium
Combi-schutz
Coralite Alcohol Pads
Easytouch Alcohol Prep Pads Nonsterile
Friction Rub
IOH
ISO-PROPANOL
Isopropyl Winter Green Rubbing Alcohol
Leader Isopropyl Alcohol Wipes
Lens Cleaner
Medpride With Wintergreen Oil
Seatex Hand Sanitizer
sec-Propanol
Shopko Alcohol Swabs
Touchland Refeel Kub Cartridge
1-Methylethanol
2-propylalcohol
Alcohol Cotton Ball
Alcohol Extra-thick
Alcohol Swab Sticks
Alko Isol
Amsure Alcohol Prep
Certus Alcohol Prep
Full Care Alcohol Swabsticks
Good Care Isopropyl Alcohol
Good Neighbor Pharmacy Alcohol Antiseptic Skin Cleanser
Good Neighbor Pharmacy Isopropyl Alcohol Wipes
i-Propanol
Iso-propyl alcohol
Isopropyl Alcohol
Isopropyl Alcohol Prep Swab
Isopropyl Rubbing Alcohol With Wintergreen Oil
Medline Alcohol Prep Medium
Mk Alcohol Swabstick Sterile
North Alcohol Wipe
Oido Sana
Rexall Alcohol Prep
Royal Alcohol Cleansing Pads
sec-Propyl alcohol
Touchland Kub2go Hand Sanitizer Strawberry
Western Family Alcohol Swabs
1-Methylethyl alcohol
AC1L1GOQ
AC1Q1QDY
Alcohol Prep Pads
Auro-dri
Bay Rum Constanza
Cal Stat
Caretouch Alcohol Prep Pad
Cvs Alcohol Prep
Dermorapid: Colourless and Coloured
Dupont Relyon Antiseptic Hand Wipes
Easytouch Alcohol Prep Pads Sterile
i-Propyl alcohol
Imsol A
Isopro First Aid
Isopropyl Alcohol Prep Pad
Isopropyl Alcohol Prep Pad Sterile
Isopropyl Alcohol Reagent Grade ACS
Isopropyl alcohol, rubbing
Mckesson Alcohol Prep Pad
Medpride Sterile Prep Pads
Pharmacist Choice Alcohol Prep Pad
Protector Alcohol Prep Pad
Smart Sense Isopropyl Alcohol Wipes
Sterile Alcohol Prep Pads
Swim-ear
Touchland Kub2go Hand Sanitizer Lavender
Touchland Kub2go Hand Sanitizer Neutral
Touchland Kub2go Hand Sanitizer Vanilla
2-Propanol
Acetone Alcohol Prep Pads Medium
Alcohol Prep Pad Medium
Alcohol Prep Pads Lightweight Non-sterile
Alcosolve 2
First Aid Only Isopropyl Alcohol
Green Guard Sterile Alcohol Pads
Hyvee Alcohol Prep Pads
i-PrOH
Iso-blu Alcohol
Isopropanol (Recovered)
Isopropanol 99%
Isopropyl Alcohol 50 Percent Wintergreen Readyincase
Isopropyl Alcohol 70 Percent Wintergreen Readyincase
Pharmacist Choice Alcohol Sterile Prep Pad
propan-2ol
propane-2ol
propanol-2
Sanitizer - Assainissant
Touchland Kub2go Hand Sanitizer Citrus
2-Propanol, Spectrophotometric Grade
Cal Stat Plus Antiseptic Handrub With Enhanced Emollients
CHEMBL582
Curad Alcohol Prep Pads Medium
Dukal Alcohol Prep Pad
Dukal Sterile Alcohol Prep Pad
Gauke Alcohol Prep Pad
Good Care Alcohol Pad
Isopropyl Alcohol 50 Percent Readyincase
Isopropyl Alcohol 70 Percent Readyincase
Isopropyl Alcohol 70 Percent Wintergreen
Isopropyl Alcohol 91 Percent Readyincase
ISOPROPYL ALCOHOL, ACS
Isopropyl Rubbing Alcohol Lil Drug Store Products
Jianze Alcohol Prep Pad Medium
Labsco Sterile Alcohol Prep Pad
Medi-first Sterile Alcohol Pads
Omnis Health Alcohol Prep Pads
Sure Comfort Alcohol Prep Pads
Touchland Kub2go Hand Sanitizer Mint
2-Propyl alcohol
50% Rubbing
70% Isopropyl Rubbing Alcohol
70% Rubbing
Alcool isopropilico [Italian]
Alcool isopropylique [French]
Curad Alcohol Sterile, Large
Curad Alcohol Sterile, Thick
Isopropyl Alcohol 99%
Isopropyl Alcohol C+
Isopropyl Rubbing Alcohol 50 Percent Wintergreen
Isopropyl Rubbing Alcohol 50%
Isopropyl Rubbing Alcohol 70 Percent Wintergreen
Isopropyl Rubbing Alcohol 70%
Isopropyl Rubbing Compound 70%
Jianze Alcohol Prep Pad Large
Moore Brand Alcohol Prep Pads
Rubbing Compound 70%
School Health Sterile Alcohol Prep Pad
2-Propanol, analytical standard
2-PROPANOL, ISOPROPANOL
91 Percent Isopropyl Alcohol
ACMC-1BI1R
Coghlans Survival In A Can
Full Care Alcohol Prep Pad
Hs-E3
IPS 1
iso-C3H7OH
Iso-propylalkohol [German]
Isopropyl Alcohol 50 Percent
Isopropyl Alcohol 70 Percent
Isopropyl Alcohol 91 Percent
Isopropyl alcohol, EuropePharmacopoeia (EP) Reference Standard
Isopropyl Rubbing Alcohol 50 Percent
Isopropyl Rubbing Alcohol 50% With Wintergreen
Isopropyl Rubbing Alcohol 70
Isopropyl Rubbing Alcohol 70 Percent
Isopropyl Rubbing Alcohol 70% With Wintergreen
Isopropyl Rubbing Alcohol 90
Isopropyl Rubbing Alcohol 91 Percent
Medi-first Plus Sterile Alcohol Pads
Medline Alcohol Prep Sterile, Large
Medline Alcohol Prep Sterile, Medium
Mk Alcohol Prep Pads Large
Mk Alcohol Prep Pads Medium
Rubbing Alcohol 70 Percent Isopropyl
Rubbing Alcohol 70%
Rubbing Alcohol 91 Percent Isopropyl
Touchland Kub2go Hand Sanitizer Aloe Vera
Up and Up Alcohol
2 -propanol
2- propanol
2-Propanol, anhydrous
Alcool Isopropylique A Friction Rouge 70%usp
Alpet E3 Hand Sanitizer Spray
Biopropyl Liq 70%
Caring Alcohol Non-sterile, Medium
Curad Alcohol Non-sterile, Medium
Cut Care Alcohol Prep Pad
Dignity Health Hand Sanitizer Cal Stat Plus Antiseptic Handrub With Enhanced Emollients
Global Easy Prep Alcohol Prep Pads
Humco Isopropyl Rubbing Alcohol 70%
Humco Isopropyl Rubbing Alcohol 70% Professional Pack
i-Propylalkohol [German]
Isopropyl alcohol (manufacture strong-acid process)
Isopropyl alcohol [USAN]
Isopropyl Alcohol 99% USP
Isopropyl Alcohol Liq 99%
KSC353M9P
Maxim 50% Isopropyl Rubbing Alcohol
Maxim 50% Isopropyl Rubbing Alcohol With Wintergreen
Maxim 70% Isopropyl Rubbing Alcohol
Maxim 70% Isopropyl Rubbing Alcohol With Wintergreen
Propan-2-ol
propane-2-ol
Rubbing Alcohol 50 Percent
Rubbing Alcohol 50 Percent With Wintergreen
Rubbing Alcohol 70 Percent
Rubbing Alcohol 70 Percent With Wintergreen
1-Hydroxy-1-methylethyl
Alcojel Gel 70%
Alpet E-3
Amg-50
Curad Alcohol Non-sterile, Large
Dop Isopropyl Rubbing Alcohol 70%
Ear Dry Drops Well At Walgreens
Isopropyl Alcohol - GMP
Isopropyl alcohol (manufacturing-strong acid process only)
Isopropyl alcohol (USP)
Isopropyl Rubbing Alcohol 50% With Wintergreen and Glycerin
Isopropyl Rubbing Alcohol Liq 70%
Medline Alcohol Prep Non-sterile, Medium
Preferred Plus Pharmacy 70% Isopropyl Alcohol Wipes
UN1219
2-Propanol, meets USP testing specifications
70% Isopropyl Alcohol Well At Walgreens
A 50% Isopropyl Rubbing Alcohol
BDBM36154
CTK2F3697
Curad Alcohol Non-sterile, Extra Thick
HMDB00863
HSDB 116
I0163
I0164
I0277
Isopro (TN)
Medline Alcohol Prep Non-sterile, Large
More Savings 50 Percent Isopropyl Rubbing Alcohol With Wintergreen
More Savings Rubbing Alcohol 50 Percent
Super Rub 70%
Viraguard! With Virahol (gel)
2-Propanol, ACS reagent
Alcohol Prep Pads - Sterile
DB02325
Freeman Packing Hand Sanitizer 004
Hibistat (Salt/Mix)
i-Propanol [German]
Medline Alcohol Prep Non-sterile, Extra Large
Medline Alcohol Prep Non-sterile, Thick/medium
RL04582
WLN: QY1&1
Zep Alpet E-3 Sanitizer
2-Propanol, HPLC Grade
Alcohol Prep Pad - Medium
C01845
CCRIS 2308
D00137
DSSTox_CID_762
I.V. Prep Antiseptic Wipe
Iso Blu 50 Percent
Isopropanol (JP17)
Isopropyl Rubbing Nf 70%v/v
LTBB002057
n-Propan-2-ol
Smart Sense 70% Isopropyl Rubbing Alcohol First Aid Antiseptic
Visco 1152
ZINC901159
2-Propanol, for HPLC
2-Propanol, GC Grade
Alcohol Prep Pad - Large
Carefine Alcohol Swabs 100 Ct
Carefine Alcohol Swabs 200 Ct
DTXSID7020762
Easy To Break-off Cleaning and Disinfecting Swabstick Dfb-I
Easy To Break-off Cleaning and Disinfecting Swabstick Ybc-I
Ecocare 350 Hand Sanitizer With Skin Conditioner
FEMA Number 2929
Isopropyl Rubbing Alcohol 70% V/v
LS-1565
NSC135801
OR034205
OR098238
OR111345
OR333756
OR336061
OR343005
Propane, 2-hydroxy-
UN 1219
2-Propanol, Ph Eur
2-Propanol, pharmaceutical secondary standard; traceable to USP
300128X
Alcohol Prep Pads - Non Sterile
Arc 42 Essential First Aid Items
CHEBI:17824
Gfa 42 Essential First Aid Items
Isopropanol, 99.5% anhydrous
PROPYL, 2-HYDROXY-
Run Kang Alcohol Pads - Medium
AN-41893
ANW-35384
DSSTox_GSID_20762
ND2M416302
Caswell No. 507
DSSTox_RID_75777
Isopropanol, 70% in H2O
MFCD00011674
ZINC00901159
AI3-01636
ISOPROPYL ALCOHOL, U.S.P.
NSC 135801
NSC-135801
RTR-022706
TR-022706
UNII-ND2M416302
2-Propanol, United States Pharmacopeia (USP) Reference Standard
AKOS000121012
Isopropyl alcohol, meets EP, BP, USP testing specifications
J-510285
2-Propanol, histological grade, 99%
BRN 0635639
FEMA No. 2929
N.A.S.99 Nail Antiseptic Spray
67-63-0
Alcohol Prep F400 70% Liq
I14-19476
Isopropyl alcohol, natural, >=98%, FG
2-Propanol, technical grade, 95%
Ethyl, 1-hydroxy-1-methyl-
Tox21_111039
Tox21_202475
2-Propanol, 99.5%
2-Propanol, LR, >=99%
CAS-67-63-0
ETHYL, 1-METHYL-1-OXY-
One Time Swab Sticks 70% F468
2-Propanol, >72% in a non hazardous diluent
2-Propanol, ACS spectrophotometric grade, >=99.5%
2-Propanol, Laboratory Reagent, >=99.5%
8013-70-5
MCULE-6646752234
NCGC00090917-01
NCGC00260024-01
2-Propanol, anhydrous, 99.5%
EINECS 200-661-7
2-Propanol, >=99.7%, suitable for absorption spectrum analysis
Isopropyl alcohol (only persons who manufacture by the strong acid process are subject, supplier notification not required)
140-EP2269975A2
140-EP2269977A2
140-EP2269989A1
140-EP2269993A1
140-EP2269994A1
140-EP2269997A2
140-EP2270000A1
140-EP2270003A1
140-EP2270008A1
140-EP2270009A1
140-EP2270011A1
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140-EP2287940A1
140-EP2289509A2
140-EP2289868A1
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140-EP2289881A1
140-EP2289884A1
140-EP2289885A1
140-EP2289890A1
140-EP2289892A1
140-EP2289897A1
140-EP2289965A1
140-EP2292222A1
140-EP2292233A2
140-EP2292234A1
140-EP2292593A2
140-EP2292597A1
140-EP2292609A1
140-EP2292612A2
140-EP2292613A1
140-EP2292614A1
140-EP2292617A1
140-EP2292620A2
140-EP2292621A1
140-EP2292622A1
140-EP2292625A1
140-EP2292628A2
140-EP2295055A2
140-EP2295401A2
140-EP2295402A2
140-EP2295406A1
140-EP2295411A1
140-EP2295415A1
140-EP2295417A1
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140-EP2295423A1
140-EP2295424A1
140-EP2295426A1
140-EP2295427A1
140-EP2295429A1
140-EP2295432A1
140-EP2295435A1
140-EP2295436A1
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140-EP2298305A1
140-EP2298313A1
140-EP2298729A1
140-EP2298732A1
140-EP2298735A1
140-EP2298742A1
140-EP2298746A1
140-EP2298747A1
140-EP2298749A1
140-EP2298752A1
140-EP2298755A1
140-EP2298760A1
140-EP2298761A1
140-EP2298763A1
140-EP2298767A1
140-EP2298768A1
140-EP2298769A1
140-EP2298770A1
140-EP2298773A1
140-EP2298775A1
140-EP2298776A1
140-EP2298778A1
140-EP2298828A1
140-EP2299785A1
140-EP2301627A1
140-EP2301912A2
140-EP2301913A1
140-EP2301914A1
140-EP2301916A2
140-EP2301925A1
140-EP2301931A1
140-EP2301934A1
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140-EP2301983A1
140-EP2302003A1
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140-EP2305682A1
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140-EP2306788A1
140-EP2306789A1
140-EP2308471A1
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140-EP2308839A1
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140-EP2308857A1
140-EP2308867A2
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141-EP2287162A1
141-EP2287165A2
141-EP2287166A2
141-EP2287168A2
141-EP2289877A1
141-EP2289890A1
141-EP2289892A1
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141-EP2292280A1
141-EP2292590A2
141-EP2292601A1
141-EP2292602A1
141-EP2292603A1
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141-EP2292612A2
141-EP2292618A1
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141-EP2292620A2
141-EP2292622A1
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141-EP2295402A2
141-EP2295409A1
141-EP2295415A1
141-EP2295417A1
141-EP2295421A1
141-EP2295430A2
141-EP2295431A2
141-EP2295437A1
141-EP2298734A2
141-EP2298735A1
141-EP2298737A1
141-EP2298739A1
141-EP2298740A1
141-EP2298741A1
141-EP2298747A1
141-EP2298750A1
141-EP2298758A1
141-EP2298759A1
141-EP2298767A1
141-EP2298768A1
141-EP2298770A1
141-EP2298771A2
141-EP2298774A1
141-EP2298775A1
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141-EP2298828A1
141-EP2299509A1
141-EP2299510A1
141-EP2301534A1
141-EP2301920A1
141-EP2301921A1
141-EP2301926A1
141-EP2301929A1
141-EP2301935A1
141-EP2301936A1
141-EP2301941A1
141-EP2305219A1
141-EP2305243A1
141-EP2305644A1
141-EP2305649A1
141-EP2305652A2
141-EP2305664A1
141-EP2305667A2
141-EP2305668A1
141-EP2305670A1
141-EP2305672A1
141-EP2305674A1
141-EP2305680A2
141-EP2305682A1
141-EP2305683A1
141-EP2305684A1
141-EP2305769A2
141-EP2308562A2
141-EP2308812A2
141-EP2308843A1
141-EP2308857A1
141-EP2308858A1
141-EP2308861A1
141-EP2308867A2
141-EP2308870A2
141-EP2308872A1
141-EP2308873A1
141-EP2308875A1
141-EP2308879A1
141-EP2309584A1
141-EP2311451A1
141-EP2311815A1
141-EP2311816A1
141-EP2311817A1
141-EP2311824A1
141-EP2311826A2
141-EP2311831A1
141-EP2311837A1
141-EP2311839A1
141-EP2311840A1
141-EP2314558A1
141-EP2314587A1
141-EP2314589A1
141-EP2316450A1
141-EP2316470A2
141-EP2316828A1
141-EP2316829A1
141-EP2316831A1
141-EP2316834A1
141-EP2316835A1
141-EP2316836A1
141-EP2316837A1
141-EP2316905A1
141-EP2316906A2
141-EP2371810A1
141-EP2371812A1
141-EP2372017A1
141-EP2372804A1
141-EP2374454A1
141-EP2374526A1
141-EP2374783A1
141-EP2378585A1
Isopropanol or isopropyl alcohol [UN1219] [Flammable liquid]
SR-01000944474
2-Propanol, ACS reagent, >=99.5%
2-Propanol, AR, >=99.5%
2-Propanol, USP, 99.0%
Isopropyl alcohol, >=99.7%, FCC, FG
2-Propanol, 99.5%, HPLC grade
2-Propanol, for HPLC, >=99.8%
2-Propanol, JIS special grade, >=99.5%
5051-EP2269975A2
5051-EP2269977A2
5051-EP2269986A1
5051-EP2269997A2
5051-EP2269999A1
5051-EP2270008A1
5051-EP2270015A1
5051-EP2272817A1
5051-EP2272825A2
5051-EP2272829A2
5051-EP2272835A1
5051-EP2272844A1
5051-EP2274983A1
5051-EP2275403A1
5051-EP2275411A2
5051-EP2275413A1
5051-EP2275414A1
5051-EP2275415A2
5051-EP2275423A1
5051-EP2277858A1
5051-EP2277871A1
5051-EP2280001A1
5051-EP2281821A1
5051-EP2284148A1
5051-EP2284157A1
5051-EP2284167A2
5051-EP2284168A2
5051-EP2284169A1
5051-EP2286811A1
5051-EP2287153A1
5051-EP2287155A1
5051-EP2287156A1
5051-EP2287161A1
5051-EP2287162A1
5051-EP2289509A2
5051-EP2289510A1
5051-EP2289879A1
5051-EP2289890A1
5051-EP2289894A2
5051-EP2292589A1
5051-EP2292592A1
5051-EP2292607A2
5051-EP2292617A1
5051-EP2295401A2
5051-EP2295406A1
5051-EP2295409A1
5051-EP2295414A1
5051-EP2295423A1
5051-EP2295437A1
5051-EP2298735A1
5051-EP2298747A1
5051-EP2298753A1
5051-EP2298755A1
5051-EP2298761A1
5051-EP2298763A1
5051-EP2298768A1
5051-EP2298770A1
5051-EP2298772A1
5051-EP2298775A1
5051-EP2301544A1
5051-EP2301627A1
5051-EP2301911A1
5051-EP2301919A1
5051-EP2305254A1
5051-EP2305625A1
5051-EP2305642A2
5051-EP2305647A1
5051-EP2305655A2
5051-EP2305662A1
5051-EP2305667A2
5051-EP2305671A1
5051-EP2305672A1
5051-EP2305676A1
5051-EP2305682A1
5051-EP2305684A1
5051-EP2305687A1
5051-EP2305769A2
5051-EP2305808A1
5051-EP2308492A1
5051-EP2308838A1
5051-EP2308839A1
5051-EP2308857A1
5051-EP2308864A1
5051-EP2308866A1
5051-EP2308877A1
5051-EP2308879A1
5051-EP2311805A1
5051-EP2311807A1
5051-EP2311830A1
5051-EP2314581A1
5051-EP2314586A1
5051-EP2314591A1
5051-EP2316827A1
5051-EP2371805A1
5051-EP2371811A2
5051-EP2374783A1
5051-EP2377841A1
5051-EP2377848A1
5051-EP2380568A1
MolPort-000-871-957
2-Propanol, 99.9%, PRA grade
2-Propanol, for HPLC, 99.5%
2-Propanol, for HPLC, 99.9%
2-Propanol, for molecular biology, BioReagent, >=99.5%
2-Propanol, SAJ first grade, >=99.0%
11948-EP2270006A1
11948-EP2270011A1
11948-EP2272537A2
11948-EP2275423A1
11948-EP2277866A1
11948-EP2280014A2
11948-EP2281559A1
11948-EP2284148A1
11948-EP2284174A1
11948-EP2287168A2
11948-EP2289509A2
11948-EP2292590A2
11948-EP2292612A2
11948-EP2292622A1
11948-EP2292628A2
11948-EP2295401A2
11948-EP2295409A1
11948-EP2298729A1
11948-EP2298734A2
11948-EP2301534A1
11948-EP2301939A1
11948-EP2305250A1
11948-EP2305652A2
11948-EP2305663A1
11948-EP2305667A2
11948-EP2305682A1
11948-EP2305695A2
11948-EP2305696A2
11948-EP2305697A2
11948-EP2305698A2
11948-EP2308812A2
11948-EP2308873A1
11948-EP2308879A1
11948-EP2311451A1
11948-EP2311824A1
11948-EP2311831A1
11948-EP2316450A1
2-Propanol, UV HPLC gradient, 99.8%
32837-EP2284167A2
32837-EP2284168A2
32837-EP2295411A1
32837-EP2301933A1
32837-EP2308812A2
32837-EP2308855A1
32837-EP2311820A1
32837-EP2311827A1
32837-EP2311850A1
40330-EP2269977A2
40330-EP2269979A1
40330-EP2270003A1
40330-EP2289881A1
40330-EP2289886A1
40330-EP2292222A1
40330-EP2295402A2
40330-EP2295423A1
40330-EP2298761A1
40330-EP2301544A1
40330-EP2305682A1
40330-EP2305684A1
40330-EP2305687A1
40330-EP2308848A1
40330-EP2308867A2
40330-EP2308870A2
40330-EP2308879A1
40330-EP2311830A1
40330-EP2371805A1
40330-EP2380871A1
45166-EP2272813A2
45166-EP2272849A1
45166-EP2289509A2
45166-EP2289879A1
45166-EP2292593A2
45166-EP2292616A1
45166-EP2292619A1
45166-EP2292622A1
45166-EP2298773A1
45166-EP2305250A1
45166-EP2305659A1
45166-EP2311821A1
45166-EP2380873A1
45166-EP2380874A2
51765-EP2270114A1
51765-EP2277866A1
51765-EP2292628A2
51765-EP2308510A1
51765-EP2308867A2
51765-EP2308870A2
51765-EP2311824A1
97840-EP2269992A1
97840-EP2289885A1
97840-EP2289896A1
97840-EP2292608A1
97840-EP2298749A1
97840-EP2305685A1
97840-EP2305686A1
97840-EP2380874A2
Isopropanol or isopropyl alcohol [UN1219] [Flammable liquid]
Oi+/-u>>u (1/4)
Oi+/-u (1/4)
OU+/-u (1/4)
SR-01000944474-1
2-Propanol, electronic grade, 99.999% trace metals basis
2-Propanol, semiconductor grade PURANAL(TM) (Honeywell 17829)
2-Propanol, anhydrous, 99.5% 250ml
2-Propanol, semiconductor grade SLSI PURANAL(TM) (Honeywell 17030)
2-Propanol, semiconductor grade ULSI PURANAL(TM) (Honeywell 17022)
2-Propanol, semiconductor grade VLSI PURANAL(TM) (Honeywell 17604)
2-Propanol, semiconductor grade MOS PURANAL(TM) (Honeywell 17930)
2-Propanol, Vetec(TM) reagent grade, anhydrous, >=99.5%
2-+/-u (1/4)
2-Propanol, >10 - 50% in a non hazardous diluent
2-Propanol, >50 - 72% in a non hazardous diluent
2-Propanol, reag. ISO, UV HPLC spectroscopic, 99.7%
4-01-00-01461 (Beilstein Handbook Reference)
2-Propanol, BioUltra, for molecular biology, >=99.5% (GC)
2-Propanol, >=99.7%, for residue analysis, suitable for 1000 per JIS
2-Propanol, HPLC Plus, for HPLC, GC, and residue analysis, 99.9%
InChI=1/C3H8O/c1-3(2)4/h3-4H,1-2H
2-Propanol, p.a., ACS reagent, reag. ISO, 99.8%
2-Propanol, puriss. p.a., ACS reagent, >=99.8% (GC)
2-Propanol, HPLC Plus, for HPLC, GC, and residue analysis, 99.9%, poly coated bottles
2-Propanol, puriss., meets analytical specification of Ph. Eur., BP, USP, >=99.5% (GC)
2-Propanol, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.8% (GC)
IUPAC namepropan-2-ol
SMILESCC(C)O
InchiInChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
FormulaC3H8O
PubChem ID3776
Molweight60.096
LogP0.25
Atoms12
Bonds11
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationAlcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for isopropanol is 8.10X10-6 atm-cu m/mole at 25 deg C(1). This Henry's Law constant indicates that isopropanol is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 86 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 29 days(SRC). Isopropanol's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Isopropanol is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 45.2 mm Hg at 25 deg C(3). The volatilization of isopropanol from a runoff tank of an industrial wastewater treatment facility was measured; the volatilization rate of isopropanol ranged between 0.64-0.69 mg/sq m-min(4). The evaporation rate of a 1:1 isopropanol:water mixture from a shallow pool was 1.5 kg/sq-m per hour at a wind speed of 4.5 m/s and pool temperature of 20 deg C and an ambient air temperature of 22 deg C(5). Laboratory studies demonstrated that isopropanol will volatilize from water to air in the absence of wind(6).
Literature: (1) Taft RW et al; Nature 313: 384-6 (1985) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng New York, NY: Hemisphere Pub Corp 5 Vol (1989) (4) Gholson AR et al; Environ Sci Technol 25: 519-24 (1991) (5) WHO; Environmental Health Criteria 103, 2-Propanol. Geneva, Switzerland: WHO International Program on Chemical Safety. pp. 1-77 (1990) (6) Hedden T et al; Haz Waste Haz Mater 7: 223-37 (1990)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of isopropanol can be estimated to be 1.5(SRC). According to a classification scheme(2), this estimated Koc value suggests that isopropanol is expected to have very high mobility in soil.
Literature: (1) Meylan WM et al; Environ Sci Technol 26: 1560-67 (1992) (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
45.4 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaAMI 386nabreathing zone of a waste collection workerWilkins, 1996
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiPenicillium Palitans (commune) (IBT 15899)n/aobtained from buildings Wilkins et al., 2000
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaAMI 386Nutrient agar CM3 + 50mg/l actidioneGC/MS
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
FungiPaecilomyces Variotii BainMEAGC/MS
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiPenicillium Palitans (commune) (IBT 15899)medium with glutamin Cultures were grown at 21-23°C for 7 days,VOC-analyse by GC/MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS


Butan-2-one

Mass-Spectra

Compound Details

Synonymous names
Aethylmethylketon
Ethylmethylcetone
Ethylmethylketon
ethylmethylketone
Methylethylketone
Metiletilchetone
Metyloetyloketon
Methylpropanone
Metiletilcetona
methylacetone
Butanone
ethyl methylketone
ethylmathyl ketone
ethylmethyl ketone
methyl ethylketone
methyl-ethylketone
Methylethyl ketone
methylethyl-ketone
Oxobutane
ZWEHNKRNPOVVGH-UHFFFAOYSA-N
Butanon
Meetco
Methyl acetone
MEK
Ethyl methyl cetone
Ethyl methyl ketone
ethyl-methyl ketone
methyl ethyl cetone
METHYL ETHYL KETONE
methyl-ethyl ketone
methyl-ethyl-ketone
Metyl ethyl ketone
n-butanone
AC1L1MTM
Aethylmethylketon [German]
Ethylmethylcetone [French]
Metiletilcetona [Spanish]
Metiletilchetone [Italian]
Metyloetyloketon [Polish]
2-Butanone
2-Oxobutane
3-Butanone
Butanone 2
Ethylmethylketon [Dutch]
2-butanal
2-butanon
6PT9KLV9IO
C2H5COCH3
Ethyl- a -Chloropropionamide
ethyl(methyl) ketone
Ketone, ethyl methyl
Ketone, methyl ethyl
Methyl Ethyl Ketone Reagent Grade ACS
methyl(ethyl) ketone
2-Butanone, analytical standard
UNII-6PT9KLV9IO
2 -butanone
2- butanone
AC1Q2S03
AC1Q2S04
Acetone, methyl-
Butan-2-one
butane-2-one
Ethyl methyl ketone or methyl ethyl ketone
HSDB 99
KSC377S9D
CHEMBL15849
Methyl ethyl ketone, ACS reagent
UN1193
ASTM-D740
CTK2H7991
E0140
HMDB00474
Ethyl methyl cetone [French]
Methyl Ethyl Ketone, pharmaceutical secondary standard; traceable to USP
RP18311
2-Butanone, HPLC Grade
C02845
CCRIS 2051
RCRA waste number U159
ZINC901514
BBL011450
Butanone 2 [French]
DTXSID3021516
LS-1761
OR034250
OR129517
OR129518
OR192028
OR225680
OR280101
STL146562
UN 1193
ZB015288
A839534
CHEBI:28398
DSSTox_CID_1516
Methyl Ethyl Ketone - Mil Spec
AN-42129
BP-30009
CJ-04546
DSSTox_GSID_21516
BB_SC-6989
BUTYL, 3-OXO-
Caswell No. 569
DSSTox_RID_76193
LMFA12000043
Methyl ethyl ketone, United States Pharmacopeia (USP) Reference Standard
MFCD00011648
ZINC00901514
AI3-07540
KB-169162
RTR-025185
TR-025185
AKOS000118991
EPA Pesticide Chemical Code 044103
ghl.PD_Mitscher_leg0.417
I14-4164
RCRA waste no. U159
FEMA No. 2170
FT-0628728
FT-0634386
78-93-3
2-Butanone, technical grade, 99%
Tox21_200041
2-Butanone, LR, >=99%
CAS-78-93-3
PROPYL, 1-METHYL-2-OXO-
MCULE-8276670748
NCGC00090973-01
NCGC00090973-02
NCGC00257595-01
2-Butanone, 97% 1L
2-Butanone, ReagentPlus(R), >=99%
EINECS 201-159-0
2-Butanone, natural, >=99%, FG
AI3-07540 (USDA)
135311-02-3
2-Butanone, ACS reagent, >=99.0%
2-Butanone, AR, >=99.5%
2-Butanone, for HPLC, >=99.7%
2-Butanone, JIS special grade, >=99.0%
5793-EP2270114A1
5793-EP2280005A1
5793-EP2281817A1
5793-EP2289879A1
5793-EP2289884A1
5793-EP2289897A1
5793-EP2292601A1
5793-EP2292602A1
5793-EP2293650A1
5793-EP2298739A1
5793-EP2298746A1
5793-EP2298771A2
5793-EP2298772A1
5793-EP2301922A1
5793-EP2305658A1
5793-EP2305667A2
5793-EP2308839A1
5793-EP2371805A1
MolPort-001-783-785
2-Butanone, SAJ first grade, >=99.0%
15136-EP2270004A1
15136-EP2270114A1
15136-EP2272813A2
15136-EP2272817A1
15136-EP2272832A1
15136-EP2272841A1
15136-EP2275395A2
15136-EP2275401A1
15136-EP2277874A1
15136-EP2289879A1
15136-EP2289893A1
15136-EP2295407A1
15136-EP2295425A1
15136-EP2295426A1
15136-EP2295427A1
15136-EP2298735A1
15136-EP2298736A1
15136-EP2298761A1
15136-EP2305642A2
15136-EP2305652A2
15136-EP2305687A1
15136-EP2308864A1
15136-EP2308877A1
15136-EP2311830A1
15136-EP2314590A1
15136-EP2316832A1
15136-EP2316833A1
15136-EP2371808A1
15136-EP2371831A1
15136-EP2374454A1
15136-EP2377842A1
15249-EP2270000A1
15249-EP2281810A1
15249-EP2286811A1
15249-EP2289897A1
15249-EP2298735A1
15249-EP2305647A1
15249-EP2305688A1
15249-EP2311830A1
15249-EP2316832A1
15249-EP2316833A1
18726-EP2289879A1
18726-EP2314576A1
23079-EP2275424A1
23079-EP2311832A1
23079-EP2311833A1
23079-EP2314591A1
26070-EP2269986A1
26070-EP2269995A1
26070-EP2270000A1
26070-EP2270009A1
26070-EP2270113A1
26070-EP2272822A1
26070-EP2272827A1
26070-EP2272832A1
26070-EP2272849A1
26070-EP2272935A1
26070-EP2274983A1
26070-EP2275407A1
26070-EP2275411A2
26070-EP2275423A1
26070-EP2275469A1
26070-EP2277866A1
26070-EP2277878A1
26070-EP2281812A1
26070-EP2281821A1
26070-EP2284146A2
26070-EP2284147A2
26070-EP2284149A1
26070-EP2284165A1
26070-EP2284174A1
26070-EP2286811A1
26070-EP2287154A1
26070-EP2287940A1
26070-EP2289868A1
26070-EP2289879A1
26070-EP2289885A1
26070-EP2289965A1
26070-EP2292592A1
26070-EP2292593A2
26070-EP2292597A1
26070-EP2292609A1
26070-EP2295423A1
26070-EP2295430A2
26070-EP2295431A2
26070-EP2295438A1
26070-EP2298729A1
26070-EP2298753A1
26070-EP2298763A1
26070-EP2298767A1
26070-EP2298828A1
26070-EP2299326A1
26070-EP2301918A1
26070-EP2301920A1
26070-EP2301924A1
26070-EP2301983A1
26070-EP2302003A1
26070-EP2305636A1
26070-EP2305642A2
26070-EP2305649A1
26070-EP2305650A1
26070-EP2305667A2
26070-EP2305676A1
26070-EP2305685A1
26070-EP2305686A1
26070-EP2308510A1
26070-EP2308562A2
26070-EP2308828A2
26070-EP2308838A1
26070-EP2308857A1
26070-EP2308858A1
26070-EP2308865A1
26070-EP2308926A1
26070-EP2309564A1
26070-EP2309584A1
26070-EP2311801A1
26070-EP2311802A1
26070-EP2311803A1
26070-EP2311815A1
26070-EP2311816A1
26070-EP2311817A1
26070-EP2314558A1
26070-EP2314577A1
26070-EP2314587A1
26070-EP2371797A1
26070-EP2371798A1
26070-EP2371800A1
26070-EP2371804A1
26070-EP2371808A1
26070-EP2371811A2
26070-EP2371814A1
26070-EP2374533A1
26070-EP2374538A1
26070-EP2374895A1
26070-EP2377845A1
26070-EP2380568A1
26070-EP2380873A1
28325-EP2270000A1
28325-EP2270008A1
28325-EP2275102A1
28325-EP2275423A1
28325-EP2277877A1
28325-EP2289879A1
28325-EP2289885A1
28325-EP2289897A1
28325-EP2292593A2
28325-EP2292617A1
28325-EP2298768A1
28325-EP2307364A1
28325-EP2308861A1
28325-EP2308865A1
28325-EP2310373A1
28325-EP2311808A1
28325-EP2311829A1
28325-EP2311840A1
28325-EP2314577A1
28325-EP2371797A1
28325-EP2371798A1
28325-EP2371800A1
28325-EP2371804A1
28325-EP2371808A1
89669-EP2277868A1
89669-EP2277869A1
89669-EP2277870A1
89669-EP2281861A2
89669-EP2292608A1
89669-EP2305033A1
113739-EP2270000A1
113739-EP2272843A1
113739-EP2272849A1
113739-EP2281817A1
113739-EP2284169A1
113739-EP2287161A1
113739-EP2287162A1
113739-EP2289877A1
113739-EP2292618A1
113739-EP2295406A1
113739-EP2298772A1
138199-EP2292592A1
138199-EP2292595A1
2-Butanone, >=99.5%, FCC, FG
2-Butanone, puriss., >=99% (GC)
Ethyl methyl ketone or methyl ethyl ketone [UN1193] [Flammable liquid]
2-Butanone, HPLC grade, for HPLC, >=99.5%
Ethyl methyl ketone or methyl ethyl ketone [UN1193] [Flammable liquid]
InChI=1/C4H8O/c1-3-4(2)5/h3H2,1-2H
2-Butanone solution, certified reference material, 2000 mug/mL in methanol: water (9:1)
2-Butanone, 5000 mug/mL in methanol: water (9:1), analytical standard
2-Butanone, puriss., ACS reagent, reag. Ph. Eur., 99.5%
2-Butanone, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99.5% (GC)
IUPAC namebutan-2-one
SMILESCCC(=O)C
InchiInChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3
FormulaCH3COCH2CH3
PubChem ID6569
Molweight72.107
LogP0.81
Atoms13
Bonds12
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationKetones

mVOC Specific Details

Volatilization
The Henry's Law constant for methyl ethyl ketone is 4.67X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that methyl ethyl ketone is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 18 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 8.2 days(SRC). Methyl ethyl ketone's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Methyl ethyl ketone is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 90.6 mm Hg(3). The volatilization half-life of methyl ethyl ketone from silt and sandy loams was measured as 4.9 days(4).
Literature: (1) Ji C, Evans EM; Environ Toxicol Chem 26(2): 231-236 (2007) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Alarie Y et al; Toxicol Appl Pharmacol 134: 92-99 (1995) (4) Anderson TA et al; J Environ Qual 20: 420-24 (1991)
Soil Adsorption
Measured Koc values of 29 and 34 were obtained for methyl ethyl ketone in a silt loam and sandy loam soil respectively(1). A measured Koc value of 3.55 has also been reported(2). According to a classification scheme(3), these Koc values suggest that methyl ethyl ketone is expected to have very high mobility in soil(SRC).
Literature: (1) Walton BT et al; J Environ Qual 21: 552-58 (1992) (2) ATSDR; Toxicological Profile for 2-Butanone. Atlanta, GA: Agency for Toxic Substances and Disease Registry, US Public Health Service (1992). Available from, as of Dec 8, 2014: http://www.atsdr.cdc.gov/toxprofiles/index.asp (3) Swann RL et al; Res Rev 85: 23 (1983)
Vapor Pressure
PressureReference
90.6 mm Hg at 25 deg CAlarie Y et al; Toxicol Appl Pharmacol 134: 92-99 (1995)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaAMI 386nabreathing zone of a waste collection workerWilkins, 1996
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Cereus YMF3·00019nanaSu et al., 2016
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaBrevibacterium Epidermidis YMF3·00155nanaSu et al., 2016
BacteriaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaCoagulase Negative Staphylococcimilk of cowsHettinga et al 2010
BacteriaEscherichia ColiNational collection of type cultures (NCTC) UKTait et al., 2014
BacteriaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaLactobacillus Caseifermented milkGallegos et al. 2017
BacteriaLactobacillus Lactis Subsp. CremorisSpanish strain collection CECTGallegos et al. 2017
BacteriaLactobacillus Lactis Subsp. LactisSpanish strain collection CECTGallegos et al. 2017
BacteriaLactobacillus Paracasei Subsp ParacaseiSpanish strain collection CECTGallegos et al. 2017
BacteriaLactobacillus Sakei CIRM467TnaSake starterPogačić et al., 2016
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaProteus Penneri YMF3·00016nanaSu et al., 2016
BacteriaProteus Vulgaris Sp.nanaSu et al., 2016
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201nanaSu et al., 2016
BacteriaSaccharomonospora Rectivirgula DSM 43113nasoilWilkins, 1996
BacteriaSaccharomonospora Viridis DSM 43017nasoilWilkins, 1996
BacteriaSalmonella Enterican/aBunge et al., 2008
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStaphylococcus Aureusmilk of cowsHettinga et al 2010
BacteriaStreptococcus Dysgalactiaemilk of cowsHettinga et al 2010
BacteriaStreptococcus Uberismilk of cowsHettinga et al 2010
BacteriaThermoactinomyces Vulgaris DSM 43016nasoilWilkins, 1996
BacteriaThermomonospora Fusca DSM 43792nasoilWilkins, 1996
FungiCandida Tropicalisn/aBunge et al., 2008
FungiMuscodor Crispansn/aMitchell et al., 2010
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPhialophora Fastigiata ConantnanaSunesson et al., 1995
FungiPhoma Sp.n/aStrobel et al., 2014
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTrichodema Pseudokoningiin/aWheatley et al., 1997
FungiTrichodema Viriden/aWheatley et al., 1997
FungiTuber SimoneaNoneNone March et al., 2006
FungiTuber Aestivumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Simonean/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Uncinatumn/aFrance, Italy, Switzerland, the UK, Austria, Romania, and HungarySplivallo et al., 2012
BacteriaAchromobacter Xylosoxidans AF411019Nematicidal activitycow dungXU et al., 2015
BacteriaArthrobacter Nicotianae JQ071518Nematicidal activitycow dungXU et al., 2015
BacteriaMycobacterium Bovisn/aMCNerney et al., 2017
BacteriaWautersiella Falsenii AM238687Nematicidal activitycow dungXU et al., 2015
BacteriaCyanobacteriaAs part of a multicomponent odour it is also an attractant for the freshwater nematode Bursilla monhystera.Schulz and Dickschat, 2007
BacteriaPseudomonas Perolens ATCC 10757nasterile fish muscle (Sebastes melanops)Miller et al., 1973
FungiTuber Aestivumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Mesentericumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Panniferumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaAMI 386Nutrient agar CM3 + 50mg/l actidioneGC/MS
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Cereus YMF3·00019LB mediumSPME-GC/MSNo
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaBrevibacterium Epidermidis YMF3·00155LB mediumSPME-GC/MSNo
BacteriaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
BacteriaCoagulase Negative StaphylococciGCMS DSQno
BacteriaEscherichia Colimilk samplesGC-MS(BPX-5)no
BacteriaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
BacteriaLactobacillus CaseiMRS agarGC-IMSyes
BacteriaLactobacillus Lactis Subsp. CremorisMRS agarGC-IMSyes
BacteriaLactobacillus Lactis Subsp. LactisMRS agarGC-IMSyes
BacteriaLactobacillus Paracasei Subsp ParacaseiMRS agarGC-IMSyes
BacteriaLactobacillus Sakei CIRM467Tcurd-based broth mediumGC/MSYes
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaProteus Penneri YMF3·00016LB mediumSPME-GC/MSNo
BacteriaProteus Vulgaris Sp.LB mediumSPME-GC/MSNo
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201LB mediumSPME-GC/MSNo
BacteriaSaccharomonospora Rectivirgula DSM 43113Nutrient agar CM3GC/MS
BacteriaSaccharomonospora Viridis DSM 43017Nutrient agar CM3GC/MS
BacteriaSalmonella Enterican/an/a
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStaphylococcus AureusGCMS DSQno
BacteriaStreptococcus DysgalactiaeGCMS DSQno
BacteriaStreptococcus UberisGCMS DSQno
BacteriaThermoactinomyces Vulgaris DSM 43016Nutrient agar CM3GC/MS
BacteriaThermomonospora Fusca DSM 43792Nutrient agar CM3GC/MS
FungiCandida Tropicalisn/an/a
FungiMuscodor Crispanspotato dextrose agarSPME-GC-MS
FungiPaecilomyces Variotii BainDG18GC/MS
FungiPenicillium Commune PittDG18GC/MS
FungiPhialophora Fastigiata ConantDG18GC/MS
FungiPhoma Sp.n/aSolid phase microextraction (SPME)
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTrichodema PseudokoningiiLow mediumGC/MS
FungiTrichodema VirideMalt extract/Low mediumGC/MS
FungiTuber SimoneaNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Uncinatumn/aSPME-GC-MS
BacteriaAchromobacter Xylosoxidans AF411019LB liquidSPME-GC/MS
BacteriaArthrobacter Nicotianae JQ071518LB liquidSPME-GC/MS
BacteriaMycobacterium BovisLoewenstein-Jensen mediaHeadspace analyze / SIFT-MS and TD-GC-MS.
BacteriaWautersiella Falsenii AM238687LB liquidSPME-GC/MS
BacteriaCyanobacterian/an/a
BacteriaPseudomonas Perolens ATCC 10757Trypticase soil agar (BBL)GC/MS
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Mesentericumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Panniferumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


2-methylpropanoic Acid

Mass-Spectra

Compound Details

Synonymous names
Dimethylacetate
Isobuttersaeure
Isobutyricacid
alpha-Methylpropanoate
alpha-Methylpropionate
Isobutanoate
Dimethylacetic acid
Isobutyrate
Isopropylformic acid
Kyselina isomaselna
methylpropionic acid
a-Methylpropanoate
a-Methylpropionate
alpha-Methylpropanoic acid
alpha-Methylpropionic acid
KQNPFQTWMSNSAP-UHFFFAOYSA-N
2-Methylpropionsaeure
Isobutanoic acid
ISOBUTYRIC ACID
isopropyl carboxylic acid
a-Methylpropanoic acid
a-Methylpropionic acid
NATURAL ISOBUTYRIC ACID
alpha-isobutyric acid
ALQ
ISB
iso-Butyrate
2-Propanecarboxylic acid
i-butyrate
Isobutyric acid, analytical standard
Nat.Isobutyric Acid
1iup
2-Methylpropanoic acid
2-Methylpropionic acid
AC1L1MVA
AC1Q5RPW
Iso-butyric acid
i-Butyric acid
.alpha.-Methylpropanoic acid
.alpha.-Methylpropionic acid
iso-C3H7COOH
2-methyl propanoic acid
2-methyl-propanoic acid
2-METHYL-PROPIONIC ACID
Kyselina isomaselna [Czech]
AC1Q1O87
Cenex RP b2
GTPL1060
Isobutyric acid (natural)
K400
KSC489M7N
Tenox EBP 2
Tenox IBP 2
Tenox IBP-2
2,2-dimethylacetic acid
Acetic acid, dimethyl-
UN2529
CTK3I9676
HMDB01873
I0103
2-Methyl Propionic Acic, Natural
ACMC-209ph0
CHEMBL108778
DB02531
Isobutyric acid, 99%
Methylpropanoic acid, 2-
NSC62780
Propanoic acid,2-methyl-
RP18490
WLN: QVY1&1
8LL210O1U0
bmse000439
C02632
HSDB 5228
ZINC901420
BBL011415
DTXSID4021636
Isobutyric acid, certified reference material, TraceCERT(R)
LS-2857
OR034208
OR249586
OR281996
OR342159
STL146521
Tenox IBP-2 Grain Pr
UN 2529
CHEBI:16135
DSSTox_CID_1636
UNII-8LL210O1U0
AN-23989
ANW-37282
Caswell No. 503AA
DSSTox_GSID_21636
KB-77935
NSC 62780
NSC-62780
Propanoic acid, 2-methyl-
Propionic acid, 2-methyl-
SC-23341
BB_SC-6843
DSSTox_RID_76250
LMFA01020071
MFCD00002658
AI3-24260
RTR-032122
Tenox IBP-2 Grain Pr.
TR-032122
AKOS000118733
EPA Pesticide Chemical Code 101502
BRN 0635770
FEMA No. 2222
FT-0625068
79-31-2
I14-10607
Z955123672
ETHYL, 1-CARBOXY-1-METHYL-
Tox21_201207
F2191-0099
PROPOXY, 2-METHYL-1-OXO-
CAS-79-31-2
Isobutyric acid, >=99%, FCC, FG
2597-39-9
MCULE-7783770647
NCGC00248957-01
NCGC00258759-01
EINECS 201-195-7
Isobutyric acid [UN2529] [Flammable liquid]
Isobutyric acid, natural, >=99%, FCC, FG
MolPort-001-783-185
996-30-5 (hydrochloride salt)
11047-EP2269610A2
11047-EP2270003A1
11047-EP2272841A1
11047-EP2275401A1
11047-EP2277848A1
11047-EP2289510A1
11047-EP2295055A2
11047-EP2298763A1
11047-EP2298772A1
11047-EP2308839A1
11047-EP2308858A1
11047-EP2311453A1
11047-EP2311816A1
11047-EP2311817A1
11047-EP2311822A1
11047-EP2316457A1
11047-EP2316458A1
11047-EP2316825A1
11047-EP2316826A1
11047-EP2316827A1
11047-EP2316828A1
11047-EP2371803A1
11047-EP2374538A1
11047-EP2374787A1
11047-EP2377843A1
88696-EP2287158A1
88696-EP2289876A1
88696-EP2295411A1
88696-EP2298777A2
88696-EP2305825A1
Isobutyric acid [UN2529] [Flammable liquid]
533-90-4 (calcium salt)
19455-20-0 (potassium salt)
22228-82-6 (ammonium salt)
Isobutyric acid, puriss. p.a., >=99.5%
4-02-00-00843 (Beilstein Handbook Reference)
InChI=1/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6
IUPAC name2-methylpropanoic acid
SMILESCC(C)C(=O)O
InchiInChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)
Formula(CH3)2CHCOOH
PubChem ID6590
Molweight88.106
LogP1.02
Atoms14
Bonds13
H-bond Acceptor2
H-bond Donor1
Chemical ClassificationAcids carboxylic acids

mVOC Specific Details

Volatilization
A pKa of 4.84(1) indicates isobutyric acid will exist almost entirely in the anion form at pH values of 5 to 9 and therefore volatilization from water surfaces and moist soil is not expected to be an important fate process(2). Isobutyric acid is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 1.81 mm Hg(3).
Literature: (1) Kortum G et al; Dissociation Constants of Organic Acids in Aqueous Solution. International Union of Pure and Applied Chemistry. London: Butterworth (1961) (2) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000) (3) Daubert TE, Danner RP; Physical & Thermodynamic Properties of Pure Chemicals 4 NY: Hemisphere Pub Corp (1989)
Soil Adsorption
The Koc of isobutyric acid is estimated as 77(SRC), using a log Kow of 0.94(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that isobutyric acid is expected to have high mobility in soil. The pKa of isobutyric acid is 4.84(4), indicating that this compound will exist almost entirely in anion form in the environment and anions generally do not adsorb more strongly to soils containing organic carbon and clay than their neutral counterparts(5).
Literature: (1) Sangster J; LOGKOW Databank. Sangster Res Lab Montreal Quebec, Canada (1994) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983) (4) Kortum G et al; Dissociation Constants of Organic Acids in Aqueous Solution. International Union of Pure and Applied Chemistry. London: Butterworth (1961) (5) Doucette WJ; pp. 141-188 in Handbook of Property Estimation Methods for Chemicals. Boethling RS, Mackay D, eds. Boca Raton, FL: Lewis Publ (2000)
Vapor Pressure
PressureReference
1.81 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaStaphylococcus Aureusn/aPreti et. al., 2009
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
BacteriaBacteroides FragilisReduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
BacteriaVeillonella Spp.Reduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
BacteriaBacteroides Distasonisn/aWiggins et al., 1985
BacteriaBacteroides Fragilisclinical exudatesJulak et al. 2003
BacteriaBacteroides Pyogenesclinical exudatesJulak et al. 2003
BacteriaBacteroides Thetaiotamicronn/aWiggins et al., 1985
BacteriaBacteroides Vulgatusn/aWiggins et al., 1985
BacteriaClostridium Bifermentansclinical exudatesJulak et al. 2003
BacteriaClostridium Difficileclinical exudatesJulak et al. 2003
BacteriaClostridium Perfringensclinical exudatesJulak et al. 2003
BacteriaClostridium Ramosumclinical exudatesJulak et al. 2003
BacteriaClostridium Septicumclinical exudatesJulak et al. 2003
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaClostridium Sporogenesn/aWiggins et al., 1985
BacteriaEnterobacter Cloacaeclinical exudatesJulak et al. 2003
BacteriaEubacterium Lentumclinical exudatesJulak et al. 2003
BacteriaPeptococcus Nigerclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Anaerobicusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Asaccharolyticusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Prevotiiclinical exudatesJulak et al. 2003
BacteriaPorphyromonas Gingivalis FDC381n/aKurita-Ochiai et al., 1995
BacteriaPorphyromonas Gingivalis W83n/aKurita-Ochiai et al., 1995
BacteriaPrevotella Intermedia ATCC 25261n/aKurita-Ochiai et al., 1995
BacteriaPrevotella Loescheii ATCC 15930n/aKurita-Ochiai et al., 1995
BacteriaSalinispora Tropica CNB-440namarine sedimentGroenhagen et al., 2016
FungiBoletus Variegatusn/aStotzky and Schenk, 1976
Fungi Muscodor AlbusEzra et al. 2004
Fungi Penicillium SppEzra et al. 2004
Fungi Polysporus SulfureusEzra et al. 2004
BacteriaStaphylococcus Xylosusn/aSchulz and Dickschat, 2007
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
FungiMuscodor Crispansn/aMitchell et al., 2010
FungiMuscodor Albus CZ-620n/aCorcuff et al., 2011
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaStaphylococcus AureusBlood agar/chocolate blood agaHS-SPME/GC-MS
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
FungiSaccharomyces Cerevisiae Y1001n/an/a
BacteriaBacteroides Fragilisn/an/a
BacteriaVeillonella Spp.n/an/a
BacteriaBacteroides Distasonisn/an/a
BacteriaBacteroides Fragilispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Thetaiotamicronn/an/a
BacteriaBacteroides Vulgatusn/an/a
BacteriaClostridium Bifermentanspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Difficilepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Perfringenspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Ramosumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Septicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Sp.n/an/a
BacteriaClostridium Sporogenesn/an/a
BacteriaEnterobacter Cloacaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaEubacterium Lentumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptococcus Nigerpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Anaerobicuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Asaccharolyticuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Prevotiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPorphyromonas Gingivalis FDC381n/an/a
BacteriaPorphyromonas Gingivalis W83n/an/a
BacteriaPrevotella Intermedia ATCC 25261n/an/a
BacteriaPrevotella Loescheii ATCC 15930n/an/a
BacteriaSalinispora Tropica CNB-440seawater-based A1GC/MS
FungiBoletus Variegatusn/an/a
Fungi Muscodor Albusno
Fungi Penicillium Sppno
Fungi Polysporus Sulfureusno
BacteriaStaphylococcus Xylosusn/an/a
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
FungiMuscodor Crispanspotato dextrose agarSPME-GC-MS
FungiMuscodor Albus CZ-620n/aHeadspace sampler/GC-MS


1,2-xylene

Mass-Spectra

Compound Details

Synonymous names
ortho-dimethylbenzene
orthoxylene
CTQNGGLPUBDAKN-UHFFFAOYSA-N
o-Dimethylbenzene
dimethyl-benzene
o-Methyltoluene
Ortho-Xylene
OXE
Xylenes ACS
2-Methyltoluene
o-Xylenes
AC1L1OBD
O-XYLENE
o-Xylene, Spectrophotometric Grade
o-Xylol
Xylene mixture of isomers
2-Xylene
m,p-Xylene
o-Xylene, analytical standard
1,2-Dimethylbenzene
1,2-Dimethylbenzol
Benzene, dimethyl-, chloromethylated
188l
KSC174O2H
Xylene, o-isomer
CHEMBL45005
Benzene, o-dimethyl-
CCRIS 905
CTK0H4723
HSDB 134
o-Xylene, HPLC Grade
S0650
1,2-Xylene
3,4-Xylene
ACMC-209rz0
BENZENE,1,2-DIMETHYL
NSC60920
o-Xylene, secondary standard traceable to NIST
Xylene, o-
bmse000526
C07212
Z2474E14QP
ZINC968282
DTXSID3021807
LS-1976
OR000301
OR245567
OR248479
OR380402
OR380403
SBB040816
STL264206
ZB015548
CHEBI:28063
DSSTox_CID_1807
o-XYLENE- D10
UNII-Z2474E14QP
AN-24318
AN-49093
ANW-40522
DSSTox_GSID_21807
METHYL,(2-METHYLPHENYL)-
NSC 60920
NSC-60920
o-Xylene, spectrophotometric grade, 98%
BDBM50008560
DSSTox_RID_76340
MFCD00008519
O-XYLENE-ALPHA,ALPHA,ALPHA,ALPHA',ALPHA',ALPHA'-D6
WLN: 1R B1
ZINC00968282
AI3-08197
RTR-033017
ST50214390
TR-004510
TR-033017
AKOS000269058
I01-4412
I01-8965
o-Xylene, anhydrous, 97%
Benzene, 1,2-dimethyl-
FT-0645147
FT-0688168
95-47-6
o-Xylene, for synthesis, 98%
Tox21_200658
F1908-0112
CAS-95-47-6
o-Xylene, for HPLC, 98%
MCULE-2208963094
NCGC00091662-01
NCGC00091662-02
NCGC00091662-03
NCGC00258212-01
EINECS 202-422-2
o-Xylene, reagent grade, >=98.0%
68411-84-7
849-EP2269975A2
849-EP2269977A2
849-EP2269986A1
849-EP2269988A2
849-EP2269989A1
849-EP2269990A1
849-EP2269993A1
849-EP2269997A2
849-EP2270113A1
849-EP2270114A1
849-EP2272516A2
849-EP2272537A2
849-EP2272813A2
849-EP2272822A1
849-EP2272830A1
849-EP2272832A1
849-EP2272841A1
849-EP2272849A1
849-EP2272935A1
849-EP2274983A1
849-EP2275105A1
849-EP2275395A2
849-EP2275403A1
849-EP2275404A1
849-EP2275407A1
849-EP2275409A1
849-EP2275410A1
849-EP2275411A2
849-EP2275414A1
849-EP2275415A2
849-EP2275427A1
849-EP2275469A1
849-EP2277848A1
849-EP2277858A1
849-EP2277865A1
849-EP2277871A1
849-EP2277878A1
849-EP2279750A1
849-EP2280000A1
849-EP2280001A1
849-EP2280005A1
849-EP2280009A1
849-EP2280011A1
849-EP2281810A1
849-EP2281812A1
849-EP2281816A1
849-EP2281818A1
849-EP2281821A1
849-EP2284159A1
849-EP2284160A1
849-EP2284165A1
849-EP2284174A1
849-EP2284920A1
849-EP2286811A1
849-EP2287141A1
849-EP2287152A2
849-EP2287159A1
849-EP2287167A1
849-EP2287940A1
849-EP2289509A2
849-EP2289868A1
849-EP2289876A1
849-EP2289884A1
849-EP2289887A2
849-EP2289888A2
849-EP2289896A1
849-EP2289965A1
849-EP2292227A2
849-EP2292586A2
849-EP2292592A1
849-EP2292593A2
849-EP2292597A1
849-EP2292599A1
849-EP2292606A1
849-EP2292609A1
849-EP2292612A2
849-EP2292624A1
849-EP2295406A1
849-EP2295409A1
849-EP2295412A1
849-EP2295413A1
849-EP2295414A1
849-EP2295421A1
849-EP2295425A1
849-EP2295426A1
849-EP2295427A1
849-EP2295433A2
849-EP2295437A1
849-EP2295438A1
849-EP2298731A1
849-EP2298744A2
849-EP2298747A1
849-EP2298750A1
849-EP2298756A1
849-EP2298763A1
849-EP2298766A1
849-EP2298767A1
849-EP2298768A1
849-EP2298770A1
849-EP2298775A1
849-EP2298777A2
849-EP2298828A1
849-EP2301922A1
849-EP2301924A1
849-EP2301925A1
849-EP2301928A1
849-EP2301934A1
849-EP2301936A1
849-EP2301983A1
849-EP2305625A1
849-EP2305640A2
849-EP2305641A1
849-EP2305642A2
849-EP2305649A1
849-EP2305651A1
849-EP2305655A2
849-EP2305658A1
849-EP2305667A2
849-EP2305668A1
849-EP2305672A1
849-EP2305676A1
849-EP2305677A1
849-EP2305685A1
849-EP2305686A1
849-EP2308471A1
849-EP2308562A2
849-EP2308838A1
849-EP2308840A1
849-EP2308844A2
849-EP2308845A2
849-EP2308846A2
849-EP2308849A1
849-EP2308850A1
849-EP2308853A1
849-EP2308854A1
849-EP2308857A1
849-EP2308858A1
849-EP2308869A1
849-EP2308877A1
849-EP2308926A1
849-EP2309564A1
849-EP2311801A1
849-EP2311802A1
849-EP2311803A1
849-EP2311804A2
849-EP2311808A1
849-EP2311810A1
849-EP2311813A1
849-EP2311815A1
849-EP2311816A1
849-EP2311817A1
849-EP2311826A2
849-EP2311829A1
849-EP2311830A1
849-EP2314558A1
849-EP2314579A1
849-EP2314583A1
849-EP2314584A1
849-EP2314586A1
849-EP2314587A1
849-EP2315502A1
849-EP2316832A1
849-EP2316833A1
849-EP2316836A1
849-EP2371795A1
849-EP2371797A1
849-EP2371798A1
849-EP2371800A1
849-EP2371804A1
849-EP2371805A1
849-EP2371810A1
849-EP2371814A1
849-EP2371831A1
849-EP2374783A1
849-EP2374895A1
849-EP2377841A1
849-EP2377845A1
849-EP2377847A1
849-EP2380568A1
849-EP2380873A1
o-Xylene, 99% 100ml
o-Xylene, SAJ special grade, >=98.5%
MolPort-016-899-217
o-Xylene [UN1307] [Flammable liquid]
15074-EP2272813A2
15074-EP2275395A2
15074-EP2316832A1
15074-EP2316833A1
15074-EP2380867A1
15075-EP2272813A2
15075-EP2275395A2
15075-EP2316832A1
15075-EP2316833A1
28308-EP2272813A2
28308-EP2275395A2
28308-EP2280005A1
28308-EP2289884A1
28308-EP2298738A1
28308-EP2305625A1
28308-EP2309584A1
28308-EP2314577A1
28308-EP2371831A1
28308-EP2380568A1
77824-EP2272846A1
77824-EP2275422A1
77824-EP2277868A1
77824-EP2277869A1
77824-EP2277870A1
77824-EP2292608A1
77824-EP2295436A1
77824-EP2298076A1
77824-EP2298077A1
77824-EP2298749A1
77824-EP2298762A2
77824-EP2298769A1
77824-EP2301353A1
77824-EP2305031A1
77824-EP2305034A1
77824-EP2305035A1
77824-EP2308866A1
77824-EP2371823A1
77824-EP2374791A1
o-Xylene [UN1307] [Flammable liquid]
o-Xylene, puriss. p.a., >=99.0% (GC)
InChI=1/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H
IUPAC name1,2-xylene
SMILESCC1=CC=CC=C1C
InchiInChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3
FormulaC6H4(CH3)2
PubChem ID7237
Molweight106.168
LogP3
Atoms18
Bonds18
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationBenzenoids alkylbenzenes

mVOC Specific Details

Volatilization
The Henry's Law constant for 2-xylene has been measured as 5.18X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that 2-xylene is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3.2 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 4.1 days(SRC). 2-Xylene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 2-Xylene is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 6.65 mm Hg at 25 deg C(3).
Literature: (1) Sanemasa I et al; Bull Chem Soc Jpn 18: 1111-230 (1982) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Institute for Physical Property Data, American Institute of Chemical Engineers. New York, NY: Hemisphere Pub Corp (1996)
Soil Adsorption
Koc values measured for 2-xylene in various soils (% organic matter) were 24 in Wendover silty clay (16.2%), 26 in Vaudreil sand loam (10.0%), 68 in St. Thomas sand (3.1%), and 138 in Grimsby silt loam (1.0%)(1). Batch adsorption tests, using three solid sandy aquifer materials gave a Koc of 129(2). The Koc for 2-xylene in surface sediments collected from the central Tamar estuary in the UK was 25.4(3). The Koc values for 2-xylene in two river sediments (% organic matter 6.5-16.9 wt%) was 209 and 251, respectively(4). According to a classification scheme(5), these measured Koc values suggests that 2-xylene is expected to have very high to moderate mobility in soil. Using OECD Guideline 121 (estimating Koc via HPLC), the Koc of 2-xylene was estimated to be 537(6). Concentration enhancement has been observed for 2-xylene in a dune-infiltration project on the Rhine River(7); however, no 2-xylene reached groundwater under a rapid infiltration site(8). The log Koc for 2-xylene in coal sediment (% organic matter 52 wt%) was 2.40(4).
Literature: (1) Nathwani JS, Phillip CR; Chemosphere 6: 157-62 (1977) (2) Abdul AS, Gibson TL, Rai DN; S Haz Waste Haz Mat 4: 211-22 (1987) (3) Vowles PD, Mantoura RFC; Chemosphere 16: 109-16 (1987) (4) Kopinke FD et al; Environ Sci Technol 29: 941-50 (1995) (5) Swann RL et al; Res Rev 85: 17-28 (1983) (6) ECHA; Search for Chemicals. o-Xylene (CAS 95-47-6) Registered Substances Dossier. European Chemical Agency. Available from, as of June 20, 2015: http://echa.europa.eu/ (7) Piet GJ et al; Quality of groundwater. Van Dwjvenbooden W et al, eds; Studies in Environ Sci 17: 557-64 (1981) (8) Tomson MB et al; Water Res 15: 1109-16 (1981)
Vapor Pressure
PressureReference
6.65 mm Hg at 25 deg C /extrapolated/Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Institute for Physical Property Data, American Institute of Chemical Engineers. New York, NY: Hemisphere Pub Corp (1996)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiPaecilomyces Variotii Bainnacompost, soils, food productsSunesson et al., 1995
BacteriaCarnobacterium Divergens 9Pn/aErcolini et al., 2009
BacteriaPseudomonas Fragi 25Pn/aErcolini et al., 2009
BacteriaSerratia Proteamaculans 42Mn/aErcolini et al., 2009
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaSerratia Spp. B675n/an/a
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTuber Aestivumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
FungiPaecilomyces Variotii BainDG18,MEAGC/MS
BacteriaCarnobacterium Divergens 9Pn/an/a
BacteriaPseudomonas Fragi 25Pn/an/a
BacteriaSerratia Proteamaculans 42Mn/an/a


2-ethylhexan-1-ol

Mass-Spectra

Compound Details

Synonymous names
Ethylhexanol
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-ethylhexylalcohol
2 Ethylhexanol
2-Aethylhexanol
2-Ethylhexanol
AC1L1PEC
2-Ethylhexyl alcohol
Exxal 8N
2-ETHYL HEXANOL
2-ethyl-hexanol
AC1Q2V9L
AC1Q7BK8
2-ethyl hexyl alcohol
Alcohol, 2-ethylhexyl
KSC175S7B
L260
ACMC-1B65F
ACMC-20msz8
CHEMBL31637
NSC9300
SCHEMBL16324
CTK0H5970
E0122
Ethylhexanol, 2-
2-Aethylhexanol [German]
LS-380
2-ethyl 1-hexanol
2-ETHYL-1-HEXANOL
2-Ethylhexan-1-ol
C02498
CCRIS 2292
DSSTox_CID_605
HMS2268N10
HSDB 1118
AK114196
DTXSID5020605
LP121394
NSC 9300
NSC-9300
OR025415
SBB059906
STL453673
CHEBI:16011
2-Ethyl-1-hexanol, analytical standard
ANW-15107
DSSTox_GSID_20605
TRA0052020
xi-2-Ethyl-1-hexanol
2-Ethyl-hexan-1-ol
DSSTox_RID_75686
LMFA05000703
MFCD00004746
AI3-00940
KB-170355
RTR-001032
ST24040552
ST51046173
TR-001032
AKOS000120105
AKOS016843836
W-109057
BRN 1719280
FEMA No. 3151
FT-0612231
FT-0627437
MLS002415694
SMR000112222
1-Hexanol, 2-ethyl-
I14-17807
Tox21_202071
Tox21_300019
WLN: Q1Y4 & 2
104-76-7
3B1-005666
2-Ethyl-1-hexanol, >=99%
MCULE-1768780358
NCGC00091294-01
NCGC00091294-02
NCGC00091294-03
NCGC00254215-01
NCGC00259620-01
Alcohols, C7-9-branched, C8-rich
CAS-104-76-7
EINECS 203-234-3
EINECS 295-250-2
2-Ethylhexan-1-ol, United States Pharmacopeia (USP) Reference Standard
91994-92-2
111675-57-1
128821-84-1
Alcohols, C7-9-iso-,C8-rich
2-Ethyl-1-hexanol, >=99.6%
MolPort-001-787-201
2-Ethyl-1-hexanol, >=99%, FG
33017-EP2305033A1
33017-EP2311815A1
33017-EP2371805A1
33017-EP2377844A2
2-Ethyl-1-hexanol, 99% 500ml
2-Ethyl-1-hexanol, SAJ first grade, >=99.0%
1-Hexanol, 2-ethyl-, (S)-
4-01-00-01783 (Beilstein Handbook Reference)
1070-10-6 (titanium(4+) salt)
2-Ethyl-1-hexanol, puriss., >=99.0% (GC)
InChI=1/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H
IUPAC name2-ethylhexan-1-ol
SMILESCCCCC(CC)CO
InchiInChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
FormulaC8H18O
PubChem ID7720
Molweight130.231
LogP2.5
Atoms27
Bonds26
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationAlcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for 2-ethylhexanol is estimated as 2.6X10-5 atm-cu m/mole(SRC) derived from its vapor pressure, 0.136 mm Hg(1), and water solubility, 880 mg/L(2). This Henry's Law constant indicates that 2-ethylhexanol is expected to volatilize from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 41 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 16 days(SRC). 2-Ethylhexanol's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 2-Ethylhexanol is not expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Data Compilation Tables of Properties of Pure Compounds. New York, NY: Amer Inst for Phys Prop Data (1989) (2) Amidon GL et al; J Pharm Sci 63: 1858-66 (1974) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of 2-ethylhexanol can be estimated to be 35(SRC). According to a classification scheme(2), this estimated Koc value suggests that 2-ethylhexanol is expected to have very high mobility in soil.
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of Feb 5, 2014: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
0.136 mm Hg at 25 deg CDaubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis, 1985
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaCarnobacterium Divergens 9Pn/aErcolini et al., 2009
BacteriaCarnobacterium Maltaromaticumn/aErcolini et al., 2009
BacteriaPseudomonas Aurantiacan/aFernando et al., 2005
BacteriaPseudomonas Chlororaphisn/aFernando et al., 2005
BacteriaPseudomonas Corrugaten/aFernando et al., 2005
BacteriaPseudomonas Fluorescensn/aFernando et al., 2005
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiAspergillus VersicolorSchleibinger et al.,2005
FungiChaetomium GlobosumSchleibinger et al.,2005
FungiEurotium AmstelodamiSchleibinger et al.,2005
FungiFusarium Graminearum 15AcDONn/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON 1001tan/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON ZFR 29n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_4n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_5n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_6n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_7n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_8n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_9n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1002tn/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 11791n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1509n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 8046n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL38369n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL6394n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 15n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 37n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 51n/aBusko et al., 2014
FungiFusarium Graminearum NIVn/aBusko et al., 2014
FungiFusarium Graminearum NIV 357n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 119n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 23n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 48n/aBusko et al., 2014
FungiFusarium Graminearum NIV_5n/aBusko et al., 2014
FungiFusarium Graminearum NIV_6n/aBusko et al., 2014
FungiFusarium Graminearum NIV_7n/aBusko et al., 2014
FungiFusarium Graminearum NIV_8n/aBusko et al., 2014
FungiPenicillium BrevicompactumSchleibinger et al.,2005
FungiPleurotus CystidiosusnanaUsami et al., 2014
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiRhizoctonia Solani AG2-2 IIIBcollection of the Sugar Beet Research Institute, Bergen op Zoom, The NetherlandsCordovez et al. 2017
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber Borchiin/aSplivallo et al., 2007
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Pumilus ES4promotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaEscherichia Coli DH5apromotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
FungiAspergillus Versicolor Tiraboschinadamp indoor environments, food productsSunesson et al., 1995
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaCarnobacterium Divergens 9Pn/an/a
BacteriaCarnobacterium Maltaromaticumn/an/a
BacteriaPseudomonas Aurantiacan/an/a
BacteriaPseudomonas Chlororaphisn/an/a
BacteriaPseudomonas Corrugaten/an/a
BacteriaPseudomonas Fluorescensn/an/a
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
FungiAspergillus Versicoloringrain wallpaperGC/MS-SIMYes
FungiChaetomium Globosumingrain wallpaperGC/MS-SIMYes
FungiEurotium Amstelodamiingrain wallpaperGC/MS-SIMYes
FungiFusarium Graminearum 15AcDONyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON 1001tayeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON ZFR 29yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_4yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_9yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1002tyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 11791yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1509yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 8046yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL38369yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL6394yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 15yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 37yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 51yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIVyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV 357yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 119yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 23yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 48yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_8yeast extract sucrose agarSPME/GC-MS
FungiPenicillium Brevicompactumingrain wallpaperGC/MS-SIMYes
FungiPleurotus CystidiosusnaGC/MS, GC-O, AEDANo
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiRhizoctonia Solani AG2-2 IIIBPotato Dextrose Agar9Tenax TA / TDGC-MSno
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTuber Aestivumn/an/a
FungiTuber Borchiin/an/a
FungiTuber Melanosporumn/an/a
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Pumilus ES4TSASPME-GCno
BacteriaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
BacteriaEscherichia Coli DH5aTSASPME-GCno
BacteriaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
FungiAspergillus Versicolor TiraboschiMEAGC/MS


Pentan-2-one

Mass-Spectra

Compound Details

Synonymous names
Metylopropyloketon
Ethylacetone
Methylpropyl ketone
Pentanone
XNLICIUVMPYHGG-UHFFFAOYSA-N
Ethyl acetone
METHYL PROPYL KETONE
Methyl-propyl-cetone
Propyl methyl ketone
Metylopropyloketon [Polish]
AC1L1PSR
AC1Q2UJA
2-pentanal
2-Pentanone
Methyl Propyl Ketone FCC
pentanone-2
3bh3
Methyl n-propyl ketone
n-propyl methyl ketone
AC1Q5CH9
UNII-Y4Y2BRI5UL component XNLICIUVMPYHGG-UHFFFAOYSA-N
2-Pentanone, analytical standard
KSC176A8R
Pentan-2-on
PENTAN-2-ONE
ACMC-1C29M
CHEMBL45345
n-C3H7COCH3
NSC5350
UN1249
CTK0H6088
HSDB 158
Methyl-propyl-cetone [French]
P0060
4-methyl-2-butanone
LS-442
RP18455
2-Pentanone (natural)
C01949
LTBB001864
WLN: 3V1
ZINC901192
DTXSID0021888
FEMA Number 2842
LP124906
NSC 5350
NSC-5350
OR034164
OR133565
OR133566
OR251179
UN 1249
ZB015252
A801775
CHEBI:16472
DSSTox_CID_1888
2-Pentanone, 90%
AN-42836
ANW-15861
CJ-04530
DSSTox_GSID_21888
I97392I10V
SC-22796
TRA0046903
DSSTox_RID_76386
LMFA12000003
MFCD00009400
ZINC00901192
AI3-32118
KB-174028
RTR-001876
TR-001876
UNII-I97392I10V
AKOS000121554
I11-0032
BRN 0506058
FEMA No. 2842
FT-0613263
2-Pentanone, reagent grade, >=90%
Tox21_201670
Tox21_303016
107-87-9
F0001-0145
MCULE-7174095676
NCGC00249095-01
NCGC00256617-01
NCGC00259219-01
2-Pentanone, ultrapure grade, >=99.5%
CAS-107-87-9
EINECS 203-528-1
2-Pentanone, 99% 25g
2-Pentanone, >=98%, FCC, FG
2-Pentanone, ReagentPlus(R), >=99%, purified by redistillation
Methyl propyl ketone [UN1249] [Flammable liquid]
MolPort-001-783-786
2-Pentanone, for HPLC, 99.5%
92819-EP2269986A1
92819-EP2287154A1
92819-EP2289879A1
92819-EP2305649A1
161716-EP2287158A1
Methyl propyl ketone [UN1249] [Flammable liquid]
4-01-00-03271 (Beilstein Handbook Reference)
InChI=1/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H
IUPAC namepentan-2-one
SMILESCCCC(=O)C
InchiInChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3
FormulaCH3(CH2)2COCH3
PubChem ID7895
Molweight86.134
LogP1.25
Atoms16
Bonds15
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationKetones Ketone

mVOC Specific Details

Volatilization
The Henry's Law constant for 2-pentanone is 8.36X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that 2-pentanone is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 12 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 6.6 days(SRC). 2-Pentanone's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 2-Pentanone is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 35.4 mm Hg(3).
Literature: (1) Shiu WY, Mackay D; J Chem Eng Data 42: 22-30 (1987) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Riddick JA et al; Organic Solvents: Physical Properties and Methods of Purification 4th ed. NY, NY: Wiley Interscience (1985)
Soil Adsorption
The Koc of 2-pentanone is estimated as 75(SRC), using a log Kow of 0.91(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 2-pentanone is expected to have high mobility in soil(SRC).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 14 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
35.4 mm Hg at 25 deg CRiddick, J.A., W.B. Bunger, Sakano T.K. Techniques of Chemistry 4th ed., Volume II. Organic Solvents. New York, NY: John Wiley and Sons., 1985.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBacillus Amyloliquefaciens UCMB5113nanaAsari et al., 2016
BacteriaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaCoagulase-negative Staphylococcin/aHettinga et al., 2008
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaEscherichia Colin/aHettinga et al., 2008
BacteriaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaLactobacillus Caseifermented milkGallegos et al. 2017
BacteriaLactobacillus Paracasei Subsp ParacaseiSpanish strain collection CECTGallegos et al. 2017
BacteriaLactobacillus Rhamnosus LSL 216nanaPogačić et al., 2016
BacteriaPaenibacillus Sp. P4narhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al., 2014
BacteriaPedobacter Sp. V48narhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al., 2014
BacteriaProteus Vulgaris Sp.nanaSu et al., 2016
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201nanaSu et al., 2016
BacteriaSerratia Liquefaciens SM 1302nasoil, water, plants; digestive tracts of rodents, insects, fish, humansSchoeller et al., 1997
BacteriaSerratia Plymuthica PRI-2Cnamaize rhizosphere, NetherlandsGarbeva et al., 2014
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStaphylococcus Aureusn/aHettinga et al., 2008
BacteriaStreptococcus Dysgalactiaen/aHettinga et al., 2008
BacteriaStreptococcus Uberisn/aHettinga et al., 2008
FungiAspergillus Nigern/aMeruva et al., 2004
FungiAspergillus Ornatusn/aMeruva et al., 2004
FungiChaetomium GlobosumSchleibinger et al.,2005
FungiEurotium AmstelodamiSchleibinger et al.,2005
Fungi Fusarium GraminearumBusko et al. 2014
FungiMortierella Isabellinamor horizon of a spruce forest soil southeastern SwedenBengtsson et al 1991
FungiPencillium ChrysogenumNoneNoneMeruva et al., 2004
FungiPenicillium BrevicompactumSchleibinger et al.,2005
FungiPenicillium Chrysogenumn/aMeruva et al., 2004
FungiRhizoctonia Solani AG2-2 IIIBcollection of the Sugar Beet Research Institute, Bergen op Zoom, The NetherlandsCordovez et al. 2017
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiTrichoderma VirideHung et al., 2013
FungiTuber MelanosporumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
BacteriaAchromobacter Xylosoxidans AF411019Nematicidal activitycow dungXU et al., 2015
BacteriaArthrobacter Nicotianae JQ071518Nematicidal activitycow dungXU et al., 2015
FungiFusarium Graminearum 15AcDONn/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON 1001tan/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON ZFR 29n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_4n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_5n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_6n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_7n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_8n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_9n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1002tn/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 11791n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1509n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 8046n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL38369n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL6394n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 15n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 37n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 51n/aBusko et al., 2014
FungiFusarium Graminearum NIVn/aBusko et al., 2014
FungiFusarium Graminearum NIV 357n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 119n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 23n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 48n/aBusko et al., 2014
FungiFusarium Graminearum NIV_5n/aBusko et al., 2014
FungiFusarium Graminearum NIV_6n/aBusko et al., 2014
FungiFusarium Graminearum NIV_7n/aBusko et al., 2014
FungiFusarium Graminearum NIV_8n/aBusko et al., 2014
BacteriaEscherichia ColiNational collection of type cultures (NCTC) UKTait et al., 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBacillus Amyloliquefaciens UCMB5113TSA/LBAGC/MSNo
BacteriaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
BacteriaCoagulase-negative StaphylococciMilkHS-SPME/GC-MS
BacteriaCollimonas Fungivorans Ter331sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCollimonas Pratensis Ter91sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaEscherichia ColiMilkHS-SPME/GC-MS
BacteriaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
BacteriaLactobacillus CaseiMRS agarGC-IMSyes
BacteriaLactobacillus Paracasei Subsp ParacaseiMRS agarGC-IMSyes
BacteriaLactobacillus Rhamnosus LSL 216curd-based broth mediumGC/MSYes
BacteriaPaenibacillus Sp. P4sand containing artificial root exudatesGC/MSNo
BacteriaPedobacter Sp. V48sand containing artificial root exudatesGC/MSNo
BacteriaProteus Vulgaris Sp.LB mediumSPME-GC/MSNo
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201LB mediumSPME-GC/MSNo
BacteriaSerratia Liquefaciens SM 1302AB medium + 1% citrateGC-FID,GC/MS
BacteriaSerratia Plymuthica PRI-2Csand containing artificial root exudatesGC/MSNo
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStaphylococcus AureusMilkHS-SPME/GC-MS
BacteriaStreptococcus DysgalactiaeMilkHS-SPME/GC-MS
BacteriaStreptococcus UberisMilkHS-SPME/GC-MS
FungiAspergillus NigerTobacco products.Closedloop stripping analysis and GC/TOF-MS.
FungiAspergillus OrnatusTobacco products.Closedloop stripping analysis and GC/TOF-MS.
FungiChaetomium Globosumingrain wallpaperGC/MS-SIMYes
FungiEurotium Amstelodamiingrain wallpaperGC/MS-SIMYes
Fungi Fusarium Graminearumno
FungiMortierella Isabellinamalt extact agardiethyl extraction, GC-MSno
FungiPencillium ChrysogenumTobacco products.Closedloop stripping analysis and GC/TOF-MS.Yes
FungiPenicillium Brevicompactumingrain wallpaperGC/MS-SIMYes
FungiPenicillium ChrysogenumTobacco products.Closedloop stripping analysis and GC/TOF-MS.
FungiRhizoctonia Solani AG2-2 IIIBPotato Dextrose Agar2Tenax TA / TDGC-MSyes
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSYes
FungiTuber MelanosporumYes
BacteriaAchromobacter Xylosoxidans AF411019LB liquidSPME-GC/MS
BacteriaArthrobacter Nicotianae JQ071518LB liquidSPME-GC/MS
FungiFusarium Graminearum 15AcDONyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON 1001tayeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON ZFR 29yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_4yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_9yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1002tyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 11791yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1509yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 8046yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL38369yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL6394yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 15yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 37yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 51yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIVyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV 357yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 119yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 23yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 48yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_8yeast extract sucrose agarSPME/GC-MS
BacteriaEscherichia Colimilk samplesGC-MS(BPX-5)no


Ethenyl Acetate

Mass-Spectra

Compound Details

Synonymous names
Essigsaeurevinylester
acetatedevinyle
aceticacid,ethenylester
aceticacid,ethyleneester
aceticacid,ethyleneether
Acetoxyethylene
Acetoxyethene
acetoxyethenr
Vinylacetaat
Vinylacetat
Vinylazetat
Ethenyl ethanoate
Vinylester kyseliny octove
XTXRWKRVRITETP-UHFFFAOYSA-N
Ethenyl acetate
Vinyl ethanoate
acetatedevinyle(french)
VINYL ACETATE
VyAc
VyAr
1-Acetoxyethylene
Octan winylu
Vinyl acetate monomer
AC1L1PTI
Acetate de vinyle
Acetic acid ethenyl ester
Acetic acid ethylene ether
VAM vinyl acetate monomer
Vinyl acetate, analytical standard
zeset r
Zeset T
Acetic acid vinyl ester
ACMC-1BXJJ
CH3CO2CH=CH2
Vinyl A monomer
Vinyl acetate, inhibited
Acetic Acid Vinyl Ester Monomer
AC1Q1L9Q
Ethanoic acid, ethenyl ester
Everflex 81L
Vinylacetaat [Dutch]
Vinylacetat [German]
Acetic acid, ethenyl ester
Acetic acid, ethylene ether
Vinile(acetato di)
Vinyl acetate H.Q
Vinyl acetate, CP
Vinyl ester of acetic acid
Vinyle(acetate de)
Acetic acid, vinyl ester
KSC176O2F
Vinylester kyseliny octove [Czech]
7215AF
NSC8404
UN1301
A0045
CTK0H6722
HSDB 190
Octan winylu [Polish]
Vinnapas A 50
X3654
ACETIC ACID ETHENYL ESTER POLYMER WITH CHLOROETHENE AND ETHENOL
LS-451
RL00338
RP18444
Vinile (acetato di)
Vinyl acetate H.Q.
Vinyle (acetate de)
A11164
Acetate de vinyle [French]
C19309
CCRIS 1306
L9MK238N77
LTBB001491
Vinyl acetate, European Pharmacopoeia (EP) Reference Standard
CHEMBL1470323
DTXSID3021431
NSC 8404
NSC-8404
OR000190
OR243287
OR243288
STL264216
WLN: 1VO1U1
A801803
CHEBI:46916
DSSTox_CID_1431
UNII-L9MK238N77
ZINC1586656
AN-13825
AN-42851
CJ-05533
DSSTox_GSID_21431
KB-62244
SC-79059
TRA0085276
DSSTox_RID_76157
MFCD00008713
ZINC01586656
AI3-18437
RTR-001901
TR-001901
AKOS009120081
I14-2690
J-002050
FT-0621762
FT-0695979
Vinile (acetato di) [Italian]
Vinyle (acetate de) [French]
Plyamul 40305-00
Tox21_200817
Unocal 76 Res S-55
108-05-4
F8880-1173
Unocal 76 Res 6206
9003-20-7
MCULE-7626795765
NCGC00091098-01
NCGC00091098-02
NCGC00258371-01
CAS-108-05-4
EINECS 203-545-4
61891-42-7
82041-23-4
85306-26-9
UN 1301 (Salt/Mix)
Vinyl acetate, stab. with 3-20 ppm hydroquinone
172702-77-1
220713-36-0
Vinyl acetate, 99%, stabilized 100ml
5492-EP2270113A1
5492-EP2272849A1
5492-EP2272935A1
5492-EP2277861A1
5492-EP2289896A1
5492-EP2298735A1
5492-EP2298755A1
5492-EP2298761A1
5492-EP2301983A1
5492-EP2305219A1
5492-EP2305683A1
5492-EP2308838A1
5492-EP2308857A1
5492-EP2309584A1
5492-EP2311801A1
5492-EP2311802A1
5492-EP2311803A1
5492-EP2311830A1
5492-EP2311839A1
5492-EP2314584A1
5492-EP2314589A1
5492-EP2316837A1
5492-EP2371814A1
5492-EP2380661A2
MolPort-001-781-486
Vinyl acetate, inhibited [UN1301] [Flammable liquid]
Vinyl acetate, contains 3-20 ppm hydroquinone as inhibitor, >=99%
Vinyl acetate, inhibited [UN1301] [Flammable liquid]
VINYL-13C2 ACETATE, 99 ATOM % 13C
InChI=1/C4H6O2/c1-3-6-4(2)5/h3H,1H2,2H
IUPAC nameethenyl acetate
SMILESCC(=O)OC=C
InchiInChI=1S/C4H6O2/c1-3-6-4(2)5/h3H,1H2,2H3
FormulaCH3COOCHCH2
PubChem ID7904
Molweight86.09
LogP0.43
Atoms12
Bonds11
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationEsters Ester alkenes

mVOC Specific Details

Volatilization
The Henry's Law constant for vinyl acetate is estimated as 5.1X10-4 atm-cu m/mole(SRC) derived from its vapor pressure, 90.2 mm Hg at 20 deg C(1), and water solubility, 20,000 mg/L(2). This Henry's Law constant indicates that vinyl acetate is expected to volatilize rapidly from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 4 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 4.2 days(SRC). The Henry's Law constant of vinyl acetate indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of vinyl acetate from dry soil surfaces may exist based upon its vapor pressure(1).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Institute Phys Prop Data, Amer Inst Chem Eng. New York, NY: Hemisphere Pub Corp (1989) (2) Riddick JA et al; Techniques of Chemistry: Organic Solvents, Physical Properties and Methods of Purification. 4th edition. New York, NY: John Wiley & Sons (1986) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
The Koc of vinyl acetate is estimated as approximately 60(SRC), using a log Kow of 0.73(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that vinyl acetate is expected to have high mobility in soil(SRC).
Literature: (1) Hansch C et al; Exploring QSAR, Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Washington,DC: Amer Chem Soc (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983)
Vapor Pressure
PressureReference
90.2 mm Hg at 20 deg C /extrapolated/Daubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaSerratia Spp. B2675n/an/a
FungiSaccharomyces Cerevisiae Y1001n/an/a
BacteriaCollimonas Pratensis Ter91Headspace trapping/GC-MS


Heptan-2-one

Mass-Spectra

Compound Details

Synonymous names
methylpentylketone
Butylacetone
2-heptanone_GurudeebanSatyavani
CATSNJVOTSVZJV-UHFFFAOYSA-N
Heptanone
Butyl acetone
HTX
Methyl pentyl ketone
Pentyl methyl ketone
1-Methylhexanal
Amyl methyl ketone
Amyl-methyl-cetone
Methyl amyl ketone
Methyl-amyl-cetone
Methyl-n-amylketone
2-Ketoheptane
2-Oxoheptane
2-heptanal
2-HEPTANONE
6-oxoheptyl
ACMC-1CMSN
heptanone-2
Ketone, methyl pentyl
Methyl n-pentyl ketone
n-Pentyl methyl ketone
AC1L1Q5I
Methyl n-amyl ketone
n-Amyl methyl ketone
2-Heptanone, analytical standard
Heptan-2-one
KSC175M3T
Methyl n-Amyl Ketone Reagent Grade
7785AF
CHEMBL18893
Ketone C-7
NSC7313
SCHEMBL29364
UN1110
CTK0H5639
HMDB03671
Nat. 2-Heptanone
Amyl-methyl-cetone [French]
Methyl Amyl Ketone (Fragrance Grade)
Methyl-amyl-cetone [French]
n-C5H11COCH3
RL00436
2-Heptanone (natural)
2-Heptanone(Methyl Amyl Ketone)
89VVP1B008
C08380
CCRIS 8809
CHEBI:5672
HSDB 1122
WLN: 5V1
2-OXOHEPTAN-3-YL
BBL011381
DTXSID5021916
FEMA Number 2544
Jsp000804
LP084116
LP100158
LP100159
LS-2784
NSC 7313
NSC-7313
OR034045
SBB061125
SCHEMBL1122991
STL146482
UN 1110
A802193
DSSTox_CID_1916
UNII-89VVP1B008
ZINC1531087
2-Heptanone, 98%
2-Heptanone, 99%
AN-22605
ANW-16152
CJ-05231
CJ-24088
DSSTox_GSID_21916
KB-68767
SC-19092
ACN-S002378
BB_SC-6722
BDBM50028842
DSSTox_RID_76400
LMFA12000004
MFCD00009513
ZINC01531087
AI3-01230
RTR-002152
ST51047182
TR-002152
AKOS000120708
I14-5855
J-509557
BRN 1699063
FEMA No. 2544
FT-0612484
TRA-0205300
Tox21_202164
Tox21_302935
110-43-0
MCULE-6017828463
NCGC00249180-01
NCGC00256611-01
NCGC00259713-01
CAS-110-43-0
EINECS 203-767-1
29299-43-2
2-Heptanone, natural, 98%, FG
2-Heptanone, >=98%, FCC, FG
2-Heptanone, 99% 100ml
MolPort-001-759-309
26073-EP2281810A1
26073-EP2289965A1
26073-EP2314558A1
n-Amyl methyl ketone [UN1110] [Flammable liquid]
n-Amyl methyl ketone [UN1110] [Flammable liquid]
4-01-00-03318 (Beilstein Handbook Reference)
InChI=1/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H
IUPAC nameheptan-2-one
SMILESCCCCCC(=O)C
InchiInChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3
FormulaC7H14O
PubChem ID8051
Molweight114.188
LogP2.14
Atoms22
Bonds21
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationKetones Ketone

mVOC Specific Details

Volatilization
An experimental Henry's Law constant of 1.69X10-4 atm cu m/mole at 25 deg C(1) indicates that 2-heptanone is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 4.8 hours(SRC). The volatilization half- life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 6 days(SRC). 2-Heptanone's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 2-Heptanone is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 3.86 mm Hg(3).
Literature: (1) Shiu WY, Mackay, D; J Chem Eng Data 42: 27-30 (1997) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Riddick JA et al; Organic Solvents 4th ed. NY: Wiley Interscience (1986)
Soil Adsorption
The Koc of 2-heptonone is estimated as 280(SRC), using a log Kow of 1.98(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 2-heptanone is expected to have moderate mobility in soil.
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR, consult. ed., Washington, DC: Amer Chem Soc p. 35 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
3.85 mm Hg at 25 deg CAmbrose D et al; J Chem Therm 7: 453-72 (1975)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaStaphylococcus AureusNational collection of type cultures (NCTC) UKTait et al., 2014
BacteriaBacillus Amyloliquefaciens UCMB5113nanaAsari et al., 2016
BacteriaBurkholderia Ambifaria LMG 19182n/arhizosphereGroenhagen et al., 2013
BacteriaCalothrix Parietina PCC 6303n/aHoeckelmann et al., 2004
BacteriaCoagulase Negative Staphylococcimilk of cowsHettinga et al 2010
BacteriaCyanobacterian/aHoeckelmann et al., 2004
BacteriaEscherichia Colin/aSiripatrawan et al., 2008
BacteriaLactobacillus Caseifermented milkGallegos et al. 2017
BacteriaLactobacillus Paracasei Subsp ParacaseiSpanish strain collection CECTGallegos et al. 2017
BacteriaLactobacillus Rhamnosus LSL 216nanaPogačić et al., 2016
BacteriaPhormidium Sp.n/aHoeckelmann et al., 2004
BacteriaProteus Vulgaris Sp.nanaSu et al., 2016
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201nanaSu et al., 2016
BacteriaPseudomonas Chlororaphis 450growth supressive effect on Agrobacterium tumefaciens C58 and Synechococcus sp. PCC 7942Rhizosphere of maize, Kiev region, UkrainePopova et al., 2014
BacteriaRivularia Sp.n/aHoeckelmann et al., 2004
BacteriaSerratia Liquefaciens SM 1302nasoil, water, plants; digestive tracts of rodents, insects, fish, humansSchoeller et al., 1997
BacteriaSerratia Marcescens Db11n/aWeise et al., 2014
BacteriaSerratia Odorifera DSM 4582n/aWeise et al., 2014
BacteriaSerratia Proteamaculans 568n/aWeise et al., 2014
BacteriaSerratia Proteamaculans 94naspoiled meatPopova et al., 2014
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStaphylococcus Aureusn/aHettinga et al., 2008
BacteriaStreptococcus Dysgalactiaemilk of cowsHettinga et al 2010
BacteriaStreptococcus Uberismilk of cowsHettinga et al 2010
FungiAspergillus Flavus NRRL 18543n/aBeck et al., 2012
FungiAspergillus Flavus NRRL 25347n/aBeck et al., 2012
FungiAspergillus Niger NRRL 326n/aBeck et al., 2012
FungiAspergillus Parasiticus NRRL 5862n/aBeck et al., 2012
FungiCeratocystis Sp.n/aStotzky and Schenk, 1976
FungiChaetomium GlobosumSchleibinger et al.,2005
FungiGanoderma Lucidumnasaprophytic on deciduous treesZiegenbein et al., 2006
FungiPenicillium Glabrum NRRL 766n/aBeck et al., 2012
FungiPenicillium Sp.n/aBjurman et al., 1997
FungiPhoma Sp. GS8-3nanaNaznin et al., 2014
FungiPleurotus CystidiosusnanaUsami et al., 2014
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiRhizopus Stolonifer NRRL 54667n/aBeck et al., 2012
FungiThielaviopsis Basicolan/aStotzky and Schenk, 1976
FungiTrichoderma Atroviriden/aCrutcher et al., 2013
FungiTrichoderma Reesein/aCrutcher et al., 2013
FungiTrichoderma Virensn/aCrutcher et al., 2013
FungiTrichoderma Viriden/aHung et al., 2013
FungiTuber AestivumnaTarsul (as normal forest); Daix (man made orchard)Molinier et al., 2015
FungiTuber IndicumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
BacteriaAchromobacter Xylosoxidans AF411019Nematicidal activitycow dungXU et al., 2015
BacteriaKlebsiella Pneumoniaeclinical isolate,bacteremic patientsRees et al. 2017
BacteriaProteus Hauseri JN092591Nematicidal activitycow dungXU et al., 2015
BacteriaPseudochrobactrum Saccharolyticum AM180484Nematicidal activitycow dungXU et al., 2015
BacteriaStreptomyces Sp. GWS-BW-H5.n/aDickschat et al., 2005_2
BacteriaWautersiella Falsenii AM238687Nematicidal activitycow dungXU et al., 2015
BacteriaXanthomonas Campestris Pv. Vesicatoria 85-10n/aWeise et al., 2012
FungiTrichoderma Atroviride ATCC 74058n/aStoppacher et al., 2010
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaStaphylococcus Aureusmilk samplesGC-MS(BPX-5)no
BacteriaBacillus Amyloliquefaciens UCMB5113naGC/MSNo
BacteriaBurkholderia Ambifaria LMG 19182Luria-Bertani medium, Malt Extractn/a
BacteriaCalothrix Parietina PCC 6303n/an/a
BacteriaCoagulase Negative StaphylococciGCMS DSQno
BacteriaCyanobacterian/an/a
BacteriaEscherichia ColiSuper broth made up of tryptone, yeast, NaClHS-SPME/GC-MS
BacteriaLactobacillus CaseiMRS agarGC-IMSyes
BacteriaLactobacillus Paracasei Subsp ParacaseiMRS agarGC-IMSyes
BacteriaLactobacillus Rhamnosus LSL 216curd-based broth mediumGC/MSYes
BacteriaPhormidium Sp.n/an/a
BacteriaProteus Vulgaris Sp.LB mediumSPME-GC/MSNo
BacteriaPseudochrobactrum Asaccharolyticum YMF3·00201LB mediumSPME-GC/MSNo
BacteriaPseudomonas Chlororaphis 450LB mediumSPME-GC/MSNo
BacteriaRivularia Sp.n/an/a
BacteriaSerratia Liquefaciens SM 1302AB medium + 1% citrateGC-FID,GC/MS
BacteriaSerratia Marcescens Db11NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Odorifera DSM 4582NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Proteamaculans 568NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Proteamaculans 94LB mediumSPME-GC/MSNo
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStaphylococcus AureusMilkHS-SPME/GC-MS
BacteriaStreptococcus DysgalactiaeGCMS DSQno
BacteriaStreptococcus UberisGCMS DSQno
FungiAspergillus Flavus NRRL 18543potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Flavus NRRL 25347potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Niger NRRL 326potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiAspergillus Parasiticus NRRL 5862potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiCeratocystis Sp.n/an/a
FungiChaetomium Globosumingrain wallpaperGC/MS-SIMYes
FungiGanoderma LucidumnaGC/MSNo
FungiPenicillium Glabrum NRRL 766potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiPenicillium Sp.n/an/a
FungiPhoma Sp. GS8-3naSPME-GC/MSNo
FungiPleurotus CystidiosusnaGC/MS, GC-O, AEDANo
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiRhizopus Stolonifer NRRL 54667potato dextrose agar and Polyunsaturated Fatty AcidsSPME/ GC-MS
FungiThielaviopsis Basicolan/an/a
FungiTrichoderma AtroviridePotato dextrose agarHS-SPME/GC-MS
FungiTrichoderma ReeseiPotato dextrose agarHS-SPME/GC-MS
FungiTrichoderma VirensPotato dextrose agarHS-SPME/GC-MS
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MS
FungiTuber AestivumnaSPME-GC/MSNo
FungiTuber IndicumYes
BacteriaAchromobacter Xylosoxidans AF411019LB liquidSPME-GC/MS
BacteriaKlebsiella PneumoniaeBHI, LB, MHB, TSBSPME / GCxGC-TOFMS
BacteriaProteus Hauseri JN092591LB liquidSPME-GC/MS
BacteriaPseudochrobactrum Saccharolyticum AM180484LB liquidSPME-GC/MS
BacteriaStreptomyces Sp. GWS-BW-H5.n/an/a
BacteriaWautersiella Falsenii AM238687LB liquidSPME-GC/MS
BacteriaXanthomonas Campestris Pv. Vesicatoria 85-10NBIIClosed airflow-system/GC-MS and PTR-MS
FungiTrichoderma Atroviride ATCC 74058Potato dextrose agarHS-SPME/GC-MS


Undecan-2-one

Mass-Spectra

Compound Details

Synonymous names
Methylnonylketone
UNDECANONE
KYWIYKKSMDLRDC-UHFFFAOYSA-N
Rue ketone
Nonyl methyl ketone
Methyl nonyl ketone
2-Hendecanone
2-Oxoundecane
2-Undecanone
AC1L1QEM
2-undecanon
Methyl Nonyl Ketone FCC
YV5DSO8CY9
METHYL N-NONYL KETONE
Ketone, methyl nonyl
AC1Q5H8X
UNII-YV5DSO8CY9
Undecan-2-one
KSC176M2T
L352
MGK Dog and Cat Repellent
ACMC-1C77Q
Mgk dog & cat repellent
NSC4028
U0006
CTK0H6629
DB08688
SCHEMBL117635
SCHEMBL249443
Undecanone-(2)
C01875
HSDB 7431
WLN: 9V1
2-Undecanone (natural)
SBB060389
AN-1415
NSC-4028
NSC 4028
STL146552
LS-3143
LP003930
Jsp000923
BBL011441
CHEMBL1236582
DTXSID2021943
ZINC1529305
CHEBI:17700
DSSTox_CID_1943
A802493
DSSTox_GSID_21943
ANW-16393
Caswell No. 573O
2-Undecanone, 99%
LMFA12000002
BB_SC-6944
MFCD00009583
DSSTox_RID_76418
AI3-03081
TR-002375
ST51046579
RTR-002375
Q-201393
EPA Pesticide Chemical Code 044102
Methyl nonyl ketone (MNK)
Nonyl methyl ketone
Methyldecananone
2-Hendecanone
Undecanone
IBI-246
BB_SC-06944
AKOS005720838
FEMA No. 3093
FT-0613466
BRN 1749573
I14-10598
2-Undecanone, natural, FCC, FG
Tox21_301385
112-12-9
MCULE-6858373499
NCGC00255160-01
NCGC00164003-01
CAS-112-12-9
EINECS 203-937-5
53452-70-3
2-Undecanone, >=98%, FCC, FG
MolPort-003-933-723
IUPAC nameundecan-2-one
SMILESCCCCCCCCCC(=O)C
InchiInChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3
FormulaC11H22O
PubChem ID8163
Molweight170.296
LogP3.92
Atoms34
Bonds33
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationKetones Ketone

mVOC Specific Details

Boiling Point
DegreeReference
231.5 deg CLide, D.R., G.W.A. Milne (eds.). Handbook of Data on Organic Compounds. Volume I. 3rd ed. CRC Press, Inc. Boca Raton ,FL. 1994., p. V5: 5176
Volatilization
The Henry's Law constant for 2-undecanone is 6.36X10-5 atm-cu m/mole(1). This Henry's Law constant indicates that 2-undecanone is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 13 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 11 days(SRC). 2-Undecanone's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 2-Undecanone is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 4.1X10-2 mm Hg(3).
Literature: (1) Buttery RG et al: J Agric Food Chem 17:385-9 (1960) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Perry RH, Green D; Perry's Chemical Handbook. Physical and Chemical data. NY,NY: McGraw-Hill 6th ed (1984)
Solubility
Insoluble in water. Soluble in ethanol, ether, acetone, benzene, carbon tetrachloride, chloroform.
Literature: Lide, D.R., G.W.A. Milne (eds.). Handbook of Data on Organic Compounds. Volume I. 3rd ed. CRC Press, Inc. Boca Raton ,FL. 1994., p. V5: 5176
Literature: #In water, 20 mg/L at 25 deg C (est)
Literature: US EPA; Estimation Program Interface (EPI) Suite. Ver.3.12. Nov 30, 2004. Available from, as of Mar 3, 2006: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of 2-undecanone can be estimated to be 278(SRC). According to a classification scheme(2), this estimated Koc value suggests that 2-undecanone is expected to have moderate mobility in soil.
Literature: (1) Meylan WM et al; Environ Sci Technol 26: 1560-67 (1992) (2) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
4.1X10-2 mm HgPerry RH, Green D; Perry's Chemical Handbook. Physical and Chemical data. NY, NY: McGraw-Hill 6th ed (1984)
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBacillus Amyloliquefaciens IN937atriggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al., 2004
BacteriaBacillus Cereus ATCC 14570American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaBacillus Polymyxa ATCC 842American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaBacillus SimplexReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBacillus SubtilisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBacillus Subtilis GB03triggers induced systemic resistance (ISR) in ArabidopsisnaRyu et al., 2004
BacteriaBacillus WeihenstephanensisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBurkholderia Ambifaria LMG 17828n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphereGroenhagen et al., 2013
BacteriaBurkholderia Ambifaria LMG 19182n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphereGroenhagen et al., 2013
BacteriaBurkholderia Andropogonis LMG 2129n/aBlom et al., 2011
BacteriaBurkholderia Caribensis LMG 18531n/aBlom et al., 2011
BacteriaBurkholderia Caryophylli LMG 2155n/aBlom et al., 2011
BacteriaBurkholderia Cepacia LMG 1222n/aBlom et al., 2011
BacteriaBurkholderia Cepacia LMG 1222 358RhizosphereBlom et al., 2011
BacteriaBurkholderia Fungorum LMG 16225n/aBlom et al., 2011
BacteriaBurkholderia Gladioli LMG 2216n/aBlom et al., 2011
BacteriaBurkholderia Glathei LMG 14190n/aBlom et al., 2011
BacteriaBurkholderia Glumae LMG 2196n/aBlom et al., 2011
BacteriaBurkholderia Graminis LMG 18924n/aBlom et al., 2011
BacteriaBurkholderia Hospita LMG 20598n/aBlom et al., 2011
BacteriaBurkholderia Lata LMG 22485n/aBlom et al., 2011
BacteriaBurkholderia Lata LMG 6993n/aBlom et al., 2011
BacteriaBurkholderia Phenazinium LMG 2247n/aBlom et al., 2011
BacteriaBurkholderia Phenoliruptrix LMG 22037n/aBlom et al., 2011
BacteriaBurkholderia Phytofirmans LMG 22487n/aBlom et al., 2011
BacteriaBurkholderia Pyrrocinia LMG 21822n/aBlom et al., 2011
BacteriaBurkholderia Terricola LMG 20594n/aBlom et al., 2011
BacteriaBurkholderia Tropica LMG 22274n/aBlom et al., 2011
BacteriaBurkholderia Xenovorans LMG 21463n/aBlom et al., 2011
BacteriaChromobacterium Violaceum CV0n/aBlom et al., 2011
BacteriaCitrobacter Freundii ATCC 33128American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaCorynebacterium Accolens V12028clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Jeikeum V12131clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Jeikeum V12209clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Minutissimum ATCC 23348clinical isolate,trunk of adult femaleLemfack et al. 2016
BacteriaCorynebacterium Striatum RV2clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Striatum V6894clinical isolateLemfack et al. 2016
BacteriaEnterobacter Aerogenes ATCC 13048American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEnterobacter Aerogenes KY2American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEnterobacter Cloacae ATCC 13047American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEnterococcus Durans ATCC 19432American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEnterococcus Faecium ATCC 19434American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEscherichia Colin/aElgaali et al., 2002
BacteriaEscherichia Coli ATCC 25922American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEscherichia Coli O157:H7China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaEscherichia Coli OP50n/aBlom et al., 2011
BacteriaKlebsiella Pneumoniaen/aElgaali et al., 2002
BacteriaLactobacillus Lactis ATCC 11454American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaLactobacillus Lactis ATCC 11955American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaLactobacillus Rhamnosus LSL 222nanaPogačić et al., 2016
BacteriaLeuconostoc Mesenteroides ATCC 8086American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaListeria Monocytogenes ATCC 19115American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaMicrobacterium OxydansReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaPandoraea Norimbergensis LMG 18379n/aBlom et al., 2011
BacteriaPseudomonas Aeruginosa PA01nanaBriard et al., 2016
BacteriaPseudomonas Aurantiacan/aFernando et al., 2005
BacteriaPseudomonas Brassicacearum USB2101reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Brassicacearum USB2102reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Brassicacearum USB2104reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Chlororaphisn/aFernando et al., 2005
BacteriaPseudomonas Chlororaphis 450inhibits growth of Synechococcus sp. PCC 7942 and Rhizoctonia solani, kills Caenorhabditis elegansRhizosphere of maize, Kiev region, UkrainePopova et al., 2014
BacteriaPseudomonas Corrugaten/aFernando et al., 2005
BacteriaPseudomonas Fluorescensn/aFernando et al., 2005
BacteriaPseudomonas Fluorescens ATCC 13525American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaPseudomonas Fluorescens WCS 417rn/aBlom et al., 2011
BacteriaPseudomonas Jessenii S34naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Putida ISOfn/aBlom et al., 2011
BacteriaPseudomonas Putida USB2105reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Tolaasii NCPPB 2192nanaCantore et al., 2015
BacteriaPseudomonas Tolaasii USB66nanaCantore et al., 2015
BacteriaSalmonella Enterica Serovar EnteritidisChina Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaSalmonella Paratyphi KYAmerican Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaSchewanella Putrefaciens ATCC 8071American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaSerratia Entomophilia A1MO2n/aBlom et al., 2011
BacteriaSerratia MarcescensReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaSerratia Marcescens Db11n/aWeise et al., 2014
BacteriaSerratia Marcescens MG1n/aBlom et al., 2011
BacteriaSerratia Odorifera DSM 4582n/aWeise et al., 2014
BacteriaSerratia Plymuthica 4Rx13n/aWeise et al., 2014
BacteriaSerratia Plymuthica AS9n/aWeise et al., 2014
BacteriaSerratia Plymuthica HRO-C48n/aBlom et al., 2011
BacteriaSerratia Plymuthica IC14n/aBlom et al., 2011
BacteriaSerratia Proteamaculans 568n/aWeise et al., 2014
BacteriaSerratia Proteamaculans B5an/aBlom et al., 2011
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaShigella Flexneri CGCMCC 1.1868China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaShigella SonneiAmerican Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaShigella Sonnei ATCCV 25931American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaStaphylococcus Epidermidis ATCC 12228Lemfack et al. 2016
BacteriaStaphylococcus Epidermidis ATCC 14990clinical isolate,noseLemfack et al. 2016
BacteriaStaphylococcus Epidermidis DSM 3269clinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Epidermidis RP62Aclinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Haemolyticus CCM 2729clinical isolate,human skinLemfack et al. 2016
BacteriaStaphylococcus Saccharolyticus B5709clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi DSMZ 4807clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi H34clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi V431clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Warneri CCM 2730clinical isolate,human skinLemfack et al. 2016
BacteriaStenotrophomonas MaltophiliaReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaStenotrophomonas Rhizophilla Ep10-p69n/aBlom et al., 2011
BacteriaStreptococcus Agalactiae ATCC 27541American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaStreptococcus Thermophilus ATCC 14485American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaStreptomyces LateritiusReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
Fungi Aspergillus Sp.Takeuchi et al. 2015
Fungi Fusarium SolaniTakeuchi et al. 2013
FungiGanoderma Lucidumnasaprophytic on deciduous treesZiegenbein et al., 2006
Fungi Penicillium SppTakeuchi et al. 2016
FungiPleurotus CystidiosusnanaUsami et al., 2014
FungiPleurotus Eryngii Var. TuoliensisnanaUsami et al., 2014
FungiSpongiporus Leucomallellusnasaprophytic mostly on wet, old pinesZiegenbein et al., 2006
FungiTrichoderma Atroviridenawater damaged buildings, BelgiumPolizzi et al., 2012
FungiTrichoderma Atroviride ATCC 74058n/aStoppacher et al., 2010
FungiTrichoderma ReeseiCrutcher et al., 2013
FungiTrichoderma VirensCrutcher et al., 2013
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber BorchiiNoneT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaSerratia Sp.Might be involved in inhibition of fungal growth.Schulz and Dickschat, 2007
BacteriaStigmatella Aurantiaca DW4/3-1n/aDickschat et al., 2005_5
BacteriaStigmatella Aurantiaca Sg A15n/aDickschat et al., 2005_5
BacteriaWautersiella Falsenii AM238687Nematicidal activitycow dungXU et al., 2015
BacteriaXanthomonas Campestris Pv. Vesicatoria 85-10n/aWeise et al., 2012
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBacillus Amyloliquefaciens IN937aMurashige and Skoog mediumcapillary GC;GC/MSYes
BacteriaBacillus Cereus ATCC 14570TS brothGC-MS SPMEyes
BacteriaBacillus Polymyxa ATCC 842TS brothGC-MS SPMEyes
BacteriaBacillus Simplexn/an/a
BacteriaBacillus Subtilisn/an/a
BacteriaBacillus Subtilis GB03Murashige and Skoog mediumcapillary GC;GC/MSYes
BacteriaBacillus Weihenstephanensisn/an/a
BacteriaBurkholderia Ambifaria LMG 17828Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Ambifaria LMG 19182Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Andropogonis LMG 2129LB and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caribensis LMG 18531LB and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caryophylli LMG 2155MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Cepacia LMG 1222MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Cepacia LMG 1222 358MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)Yes
BacteriaBurkholderia Fungorum LMG 16225LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Gladioli LMG 2216LB, MR-VP and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Glathei LMG 14190LB Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Glumae LMG 2196MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Graminis LMG 18924LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Hospita LMG 20598LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Lata LMG 22485AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Lata LMG 6993MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Phenazinium LMG 2247LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Phenoliruptrix LMG 22037LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Phytofirmans LMG 22487LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Pyrrocinia LMG 21822LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Terricola LMG 20594LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Tropica LMG 22274LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Xenovorans LMG 21463LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaChromobacterium Violaceum CV0LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaCitrobacter Freundii ATCC 33128TS brothGC-MS SPMEyes
BacteriaCorynebacterium Accolens V12028brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Jeikeum V12131brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Jeikeum V12209brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Minutissimum ATCC 23348brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Striatum RV2brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Striatum V6894brain heart infusion mediumPorapak / GC/MSno
BacteriaEnterobacter Aerogenes ATCC 13048TS brothGC-MS SPMEyes
BacteriaEnterobacter Aerogenes KY2TS brothGC-MS SPMEyes
BacteriaEnterobacter Cloacae ATCC 13047TS brothGC-MS SPMEyes
BacteriaEnterococcus Durans ATCC 19432TS brothGC-MS SPMEyes
BacteriaEnterococcus Faecium ATCC 19434TS brothGC-MS SPMEyes
BacteriaEscherichia ColiTS brothHS-SPME/GC-MS
BacteriaEscherichia Coli ATCC 25922TS brothGC-MS SPMEyes
BacteriaEscherichia Coli O157:H7Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaEscherichia Coli OP50MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaKlebsiella PneumoniaeTS brothHS-SPME/GC-MS
BacteriaLactobacillus Lactis ATCC 11454TS brothGC-MS SPMEyes
BacteriaLactobacillus Lactis ATCC 11955TS brothGC-MS SPMEyes
BacteriaLactobacillus Rhamnosus LSL 222curd-based broth mediumGC/MSYes
BacteriaLeuconostoc Mesenteroides ATCC 8086TS brothGC-MS SPMEyes
BacteriaListeria Monocytogenes ATCC 19115TS brothGC-MS SPMEyes
BacteriaMicrobacterium Oxydansn/an/a
BacteriaPandoraea Norimbergensis LMG 18379LB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Aeruginosa PA01minimal medium/ Brian mediumSPME-GC/MSNo
BacteriaPseudomonas Aurantiacan/an/a
BacteriaPseudomonas Brassicacearum USB2101King's B AgarSPME-GC/MSNo
BacteriaPseudomonas Brassicacearum USB2102King's B AgarSPME-GC/MSNo
BacteriaPseudomonas Brassicacearum USB2104King's B AgarSPME-GC/MSNo
BacteriaPseudomonas Chlororaphisn/an/a
BacteriaPseudomonas Chlororaphis 450LB mediumSPME-GC/MSNo
BacteriaPseudomonas Corrugaten/an/a
BacteriaPseudomonas Fluorescensn/an/a
BacteriaPseudomonas Fluorescens ATCC 13525TS brothGC-MS SPMEyes
BacteriaPseudomonas Fluorescens WCS 417rLB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Jessenii S34LB mediumGC/MSYes
BacteriaPseudomonas Putida ISOfLB and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaPseudomonas Putida USB2105King's B AgarSPME-GC/MSNo
BacteriaPseudomonas Tolaasii NCPPB 2192KBSPME-GC
BacteriaPseudomonas Tolaasii USB66KBSPME-GC
BacteriaSalmonella Enterica Serovar EnteritidisTrypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaSalmonella Paratyphi KYTS brothGC-MS SPMEyes
BacteriaSchewanella Putrefaciens ATCC 8071TS brothGC-MS SPMEyes
BacteriaSerratia Entomophilia A1MO2LB and MSHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Marcescensn/an/a
BacteriaSerratia Marcescens Db11NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Marcescens MG1LB, MS, Angle and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Odorifera DSM 4582NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Plymuthica 4Rx13NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Plymuthica AS9NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Plymuthica HRO-C48LB, MS and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Plymuthica IC14LB, MS, Angle and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Proteamaculans 568NBIIHeadspace trapping/ GC-MS
BacteriaSerratia Proteamaculans B5aLB, MS and MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaShigella Flexneri CGCMCC 1.1868Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaShigella SonneiTS brothGC-MS Super Qyes
BacteriaShigella Sonnei ATCCV 25931TS brothGC-MS SPMEyes
BacteriaStaphylococcus Epidermidis ATCC 12228brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis ATCC 14990brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis DSM 3269brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis RP62Abrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Haemolyticus CCM 2729brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Saccharolyticus B5709brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi DSMZ 4807brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi H34brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi V431brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Warneri CCM 2730brain heart infusion mediumPorapak / GC/MSno
BacteriaStenotrophomonas Maltophilian/an/a
BacteriaStenotrophomonas Rhizophilla Ep10-p69LBHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaStreptococcus Agalactiae ATCC 27541TS brothGC-MS SPMEyes
BacteriaStreptococcus Thermophilus ATCC 14485TS brothGC-MS SPMEyes
BacteriaStreptomyces Lateritiusn/an/a
Fungi Aspergillus Sp.no
Fungi Fusarium Solanino
FungiGanoderma LucidumnaGC/MSNo
Fungi Penicillium Sppno
FungiPleurotus CystidiosusnaGC/MS, GC-O, AEDANo
FungiPleurotus Eryngii Var. TuoliensisnaGC/MS, GC-O, AEDANo
FungiSpongiporus LeucomallellusnaGC/MSNo
FungiTrichoderma Atroviridemalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
FungiTrichoderma Atroviride ATCC 74058Potato dextrose agarHS-SPME/GC-MS
FungiTrichoderma ReeseiPotato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma VirensPotato dextrose agarHS-SPME/GC-MS no
FungiTuber Aestivumn/an/a
FungiTuber BorchiiNoneNoneYes
FungiTuber Melanosporumn/an/a
BacteriaSerratia Sp.n/an/a
BacteriaStigmatella Aurantiaca DW4/3-1n/an/a
BacteriaStigmatella Aurantiaca Sg A15n/an/a
BacteriaWautersiella Falsenii AM238687LB liquidSPME-GC/MS
BacteriaXanthomonas Campestris Pv. Vesicatoria 85-10NBIIClosed airflow-system/GC-MS and PTR-MS


2-methylbutanoic Acid

Mass-Spectra

Compound Details

Synonymous names
Ethylmethylacetate
Methylbutyricacid
Ethylmethylacetic acid
Methylethylacetic acid
cavity conditioner
Methylbutyric acid
WLAMNBDJUVNPJU-UHFFFAOYSA-N
alpha-Methylbutyric acid
GC Conditioner
2-Ethylpropionate
2-Methylbutyrate
2-methylbutans
Active valeric acid
Methyl butyric acid
2-Ethylpropionic acid
2-Methylbutanoic acid
AC1Q5RQD
alpha-methyl butyric Acid
2-Methybutyric acid
2-METHYLBUTYRIC ACID
DL-2-Methylbutyrate
ethyl methyl acetic acid
NATURAL 2-METHYLBUTYRIC ACID
2-Methyl Butyrate
AC1L1QQ8
AC1Q2S2W
ACMC-20apgr
butane-2-carboxylic acid
Valeric acid, active
.alpha.-Methylbutyric acid
2-methyl-butanoic acid
2-Methylbutyric acid, analytical standard
DL-2-Methylbutyric acid
PAA170
PAA20 cpd
PAA60 cpd
2-Methyl butyric acid
2-methyl-butyric acid
Carbomer 941
carbomer-934
Carbopol 910
Carbopol 934
Carbopol 974P
KSC174S5L
Pemulen TR-1
Pemulen TR-2
2-Methyl-Butyric Acid Anion
Butanoic acid, methyl-
D-2-Methyl Butyrate
DL-2-Methy Butyrate
NSC7304
SCHEMBL49960
Carbomer 1342
Carbopol 1342
CTK0H4955
DL-ALPHA-METHYL-N-BUTYRIC ACID
HMDB02176
M0181
Butanoicacid, 2-methyl-
D-2-Methyl Butyric acid
DL-2-Methy Butyric acid
RP18771
VC31128
2-Methylbutyric acid (natrual)
C18319
HMS2270O06
LTBB002136
AM802977
CHEMBL1160012
DTXSID5021621
LS-2915
NSC 7304
NSC-7304
OR129719
OR129720
OR206578
2-METHYLBUTANOIC ACID (DL)
2-Methylbutyric acid (VAN)
A811487
CHEBI:37070
DSSTox_CID_1621
Nat. 2-Methyl Butyric Acid
2-Methylbutyric acid, 98%
AB1011869
AK-77434
AN-21587
AN-22760
AN-49786
ANW-16971
Butanoic acid, 2-methyl-
DSSTox_GSID_21621
KB-25100
LS-14739
Polymer of acrylic acid, cross-linked with allyl ethers of pentaerythritol
SC-22738
TRA0047814
Butyric acid, 2-methyl-
DSSTox_RID_76241
LMFA01020072
MFCD00002669
AI3-24202
CS-W001942
DB-003300
KB-231694
RTR-032178
RTR-033536
ST24028102
TR-032178
TR-033536
(1)-2-Methylbutyric acid
AKOS000121120
AKOS016843247
Carbomer 934 [USAN]
Carbomer 934p [USAN]
Carbomer 940 [USAN]
I04-0220
J-509893
Polymer of acrylic acid, cross-linked with allyl ethers of sucrose or pentaerythritol
(+)-2-methylbutanoic acid
(RS)-2-methyl-butyric acid
BRN 1098537
FEMA No. 2695
FT-0604458
FT-0605255
FT-0671578
MLS001055480
SMR000112113
I04-12788
Polymer of 2-propenoic acid, cross-linked with allyl ethers of pentaerythritol
2-Methylbutyric acid, >=98%, FG
Tox21_201807
Tox21_303584
116-53-0
600-07-7
F0001-0289
Z1245580532
Polymer of 2-propenoic acid, cross-linked with allyl ethers of sucrose or pentaerythritol
MCULE-5615925204
NCGC00090971-01
NCGC00090971-02
NCGC00257513-01
NCGC00259356-01
Polymer of 2-propenoic acid, cross-linked with allyl ethers of sucrose
(+/-)-2-Methylbutyrate
2-Methylbutyric acid; ( inverted exclamation markA)-2-Methylbutyric acid
CAS-116-53-0
EINECS 204-145-2
EINECS 209-982-7
(+/-)-2-Methylbutyric acid
MolPort-001-779-742
MolPort-039-193-764
Butyric acid, 2-methyl- (6CI,8CI)
(.+/-.)-2-Methylbutanoic acid
Butanoic acid, 2-methyl-, (S)-
Polymer of acrylic acid, cross-linked with allyl ethers of pentaerythritol. Molecular weight is approximately 750,000
4-02-00-00889 (Beilstein Handbook Reference)
Butanoic acid, 2-methyl-, (+ -)
Polymer of acrylic acid, cross-linked with allyl ethers of sucrose or pentaerythritol. Molecular weight is approximately 3,000,000
(+/-)-2-Methylbutyric acid, natural, >=98%, FG
Polymer of acrylic acid, cross-linked with allyl ethers of sucrose. Molecular weight is approximately 3,000,000
The viscosity of a neutralized 1.0 percent aqueous dispersion of Carbomer 1342 is between 9,500 and 26,500 centipoises
IUPAC name2-methylbutanoic acid
SMILESCCC(C)C(=O)O
InchiInChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)
FormulaC5H10O2
PubChem ID8314
Molweight102.133
LogP1.46
Atoms17
Bonds16
H-bond Acceptor2
H-bond Donor1
Chemical ClassificationAcids carboxylic acids esters

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaStaphylococcus Aureusn/aPreti et. al., 2009
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
BacteriaStaphylococcus Aureusn/aHettinga et al., 2008
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
BacteriaLactobacillus Paracasei LSL 248nanaPogačić et al., 2016
BacteriaStaphylococcus AureusNational collection of type cultures (NCTC) UKTait et al., 2014
BacteriaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
BacteriaStaphylococcus Sciuriattract Episyrphus balteatus; induced E. balteatus ovipositionfrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al., 2011
BacteriaStaphylococcus Xylosusn/aSchulz and Dickschat, 2007
FungiAspergillus UstusPolizzi et al., 2012
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Pumilus ES4promotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaStigmatella Aurantiaca DW4/3-1n/aDickschat et al., 2005_5
Fungi Muscodor AlbusEzra et al. 2006
Fungi Penicillium SppEzra et al. 2006
Fungi Polysporus SulfureusEzra et al. 2006
BacteriaCorynebacterium Striatum RV2clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Striatum V6894clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Epidermidis ATCC 12228Lemfack et al. 2016
BacteriaStaphylococcus Epidermidis ATCC 14990clinical isolate,noseLemfack et al. 2016
BacteriaStaphylococcus Epidermidis DSM 3269clinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Epidermidis RP62Aclinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Haemolyticus CCM 2729clinical isolate,human skinLemfack et al. 2016
BacteriaStaphylococcus Intermedius 9Sclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Saccharolyticus B5709clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi DSMZ 4807clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi H34clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi V431clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri ATCC 29061Southernflying squirrel skinLemfack et al. 2016
BacteriaStaphylococcus Sciuri H4286clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri ORclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri V405clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri Yclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Warneri CCM 2730clinical isolate,human skinLemfack et al. 2016
BacteriaCollimonas Pratensis TER91narhizosphere of Marram grass in sandy dune soils, NetherlandsGarbeva et al., 2014
BacteriaMycobacterium Bovisn/aMCNerney et al., 2018
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaStaphylococcus AureusBlood agar/chocolate blood agaHS-SPME/GC-MS
BacteriaSerratia Spp. B675n/an/a
FungiSaccharomyces Cerevisiae Y1001n/an/a
BacteriaStaphylococcus AureusMilkHS-SPME/GC-MS
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
BacteriaLactobacillus Paracasei LSL 248curd-based broth mediumGC/MSYes
BacteriaStaphylococcus Aureusblood/choclate agarGC-Ms flame photometric detectorno
BacteriaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
BacteriaStaphylococcus Sciuri874 liquid mediumSPME-GC/MS
BacteriaStaphylococcus Xylosusn/an/a
FungiAspergillus Ustusmalt extract agar (MEA), wallpaper, plasterboardSPME/GC-MS
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Pumilus ES4TSASPME-GCno
BacteriaStigmatella Aurantiaca DW4/3-1n/an/a
Fungi Muscodor Albusno
Fungi Penicillium Sppno
Fungi Polysporus Sulfureusno
BacteriaCorynebacterium Striatum RV2brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Striatum V6894brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis ATCC 12228brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis ATCC 14990brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis DSM 3269brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis RP62Abrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Haemolyticus CCM 2729brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Intermedius 9Sbrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Saccharolyticus B5709brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi DSMZ 4807brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi H34brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi V431brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri ATCC 29061brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri H4286brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri ORbrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri V405brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri Ybrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Warneri CCM 2730brain heart infusion mediumPorapak / GC/MSno
BacteriaCollimonas Pratensis TER91sand containing artificial root exudatesGC/MSNo
BacteriaMycobacterium BovisLoewenstein-Jensen mediaHeadspace analyze / SIFT-MS and TD-GC-MS.


Ethyl Acetate

Mass-Spectra

Compound Details

Synonymous names
Essigsaeureethylester
Acetoxyethane
Aethylacetat
Ethylacetaat
Ethylacetate
Essigester
Ethylazetat
Acetidin
Ethylester kyseliny octove
XEKOWRVHYACXOJ-UHFFFAOYSA-N
acet-ethylester
Acetate d'ethyle
Ethyl ethanoate
Vinegar naphtha
acetic acid ethylester
acetic-acid-ethylester
AcOEt
ehtyl acetate
ETHYL ACETATE
ethyl-acetate
EtOAc
Acetic ester
Acetic ether
Acetyl ester
EEE
ethyl acetat
Ethyl Acetate Natural
Ethyl acetate, Spectrophotometric Grade
Ethyl ester
Octan etylu
1-acetoxyethane
acetic ethyl ester
ethyl acetate ester
Ethyl acetic ester
Acetato de etilo
acetic acid ethyl
Ethyl acetate, analytical standard
Ethyl acetate, Environmental Grade
Nat.Ethyl Acetate
acet-eth-ester
Acetic acid ethyl ester
ACETIC ACID,ETHYL ESTER
ACMC-1BTXP
Ethyl acetate HPLC grade
Aethylacetat [German]
CH3COOC2H5
Ethyl Acetate Reagent Grade ACS
AC1L1RU4
AC1Q35EC
Essigester [German]
Ethyl Acetate, HPLC
Ethylacetaat [Dutch]
ETHYL ACETATE, ACS
Ethyl acetate, ACS reagent
Ethyl ester of acetic acid
Ethyle(acetate d')
Etile(acetato di)
Acetate d'ethyle [French]
Acetic acid, ethyl ester
Ethyl acetate, ACS grade
Ethyl acetate, HPLC Grade
Ethylester kyseliny octove [Czech]
HSDB 83
KSC492C3D
UNII-LM8ZO3J16V component XEKOWRVHYACXOJ-UHFFFAOYSA-N
CHEMBL14152
Ethyl acetate (natural)
Ethyl acetate, for HPLC
UN1173
A0030
c0036
CTK3J2131
E1504
Ethyl acetate GC, for residue analysis
Octan etylu [Polish]
Q0040
Q0044
Ethyl acetate (NF)
Ethyl acetate [NF]
Ethyle (acetate d')
Etile (acetato di)
LS-831
NSC70930
RL01740
76845O8NMZ
Acetato de etilo [Spanish]
C00849
CCRIS 6036
D02319
LTBB002232
RCRA waste number U112
WLN: 2OV1
ZINC895412
DTXSID1022001
OR000208
OR219292
OR253316
OR253317
STL282717
UN 1173
ZB015033
300085X
A807811
CHEBI:27750
DSSTox_CID_2001
Ethyl acetate, United States Pharmacopeia (USP) Reference Standard
UNII-76845O8NMZ
AN-23212
ANW-42221
CH3-CO-O-CH3
DSSTox_GSID_22001
Ethyl Acetate, pharmaceutical secondary standard; traceable to USP, PhEur
KB-51510
NSC 70930
NSC-70930
SC-22781
BDBM50128823
Caswell No. 429
DSSTox_RID_76453
MFCD00009171
ZINC00895412
AI3-00404
Ethyl acetate, >=99.5%
Ethyl acetate, tested according to Ph.Eur.
RTR-005372
TR-005372
AKOS000121947
EPA Pesticide Chemical Code 044003
Epitope ID:116868
Ethyl acetate, 99.9%
Ethyl acetate, AR, >=99%
Ethyl acetate, LR, >=99%
I14-2577
J-007556
J-521240
RCRA waste no. U112
FEMA No. 2414
FT-0621744
FT-0693343
Ethyl acetate, >82% in a non hazardous diluent
Ethyle (acetate d') [French]
Etile (acetato di) [Italian]
Ethyl acetate, anhydrous, 99.8%
ETHYL, 1-(ACETYLOXY)-
ETHYL, 2-(ACETYLOXY)-
Tox21_111166
Tox21_202512
141-78-6
F0001-0489
Ethyl acetate, >=99%, FCC, FG
Ethyl acetate, ACS reagent, >=99.5%
MCULE-6628539781
NCGC00091766-01
NCGC00260061-01
CAS-141-78-6
EINECS 205-500-4
Ethyl acetate, capillary GC grade, >=99.5%
Ethyl acetate, for HPLC, >=99.5%
Ethyl acetate, for HPLC, >=99.7%
Ethyl acetate, for HPLC, >=99.8%
Ethyl acetate, HPLC grade, 99.8%
Ethyl acetate, JIS special grade, >=99.5%
Ethyl acetate, PRA grade, >=99.5%
Ethyl acetate, SAJ first grade, >=99.0%
936-EP0930075A1
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936-EP2371831A1
936-EP2374454A1
936-EP2374538A1
936-EP2374788A1
936-EP2374790A1
936-EP2377845A1
936-EP2377847A1
936-EP2380568A1
936-EP2380661A2
936-EP2380867A1
936-EP2380873A1
936-EP2380874A2
949-EP2269996A1
949-EP2270003A1
949-EP2270008A1
949-EP2270009A1
949-EP2272830A1
949-EP2275413A1
949-EP2275421A1
949-EP2281820A2
949-EP2281822A1
949-EP2284174A1
949-EP2287156A1
949-EP2287157A1
949-EP2287159A1
949-EP2292617A1
949-EP2295428A2
949-EP2295433A2
949-EP2295441A2
949-EP2298735A1
949-EP2298754A1
949-EP2298762A2
949-EP2298774A1
949-EP2298783A1
949-EP2301921A1
949-EP2301926A1
949-EP2301932A1
949-EP2301940A1
949-EP2305646A1
949-EP2305695A2
949-EP2305696A2
949-EP2305697A2
949-EP2305698A2
949-EP2308845A2
949-EP2308846A2
949-EP2308851A1
949-EP2308861A1
949-EP2308867A2
949-EP2308870A2
949-EP2308876A1
949-EP2311494A1
949-EP2311840A1
949-EP2311841A1
949-EP2314576A1
949-EP2316824A1
949-EP2316832A1
949-EP2316833A1
949-EP2380871A1
Ethyl acetate, biotech. grade, >=99.8%
Ethyl acetate, ReagentPlus(R), >=99.5%
Ethyl acetate, ReagentPlus(R), >=99.8%
Ethyl acetate [UN1173] [Flammable liquid]
6822-EP1441224A2
Ethyl acetate, natural, >=99%, FCC, FG
MolPort-000-871-940
37556-EP2305808A1
37556-EP2311802A1
37556-EP2311803A1
Ethyl acetate, for residue analysis, suitable for 5000 per JIS
Ethyl acetate, Laboratory Reagent, >=99.0% (GC)
Ethyl acetate [UN1173] [Flammable liquid]
Ethyl acetate, >10 - 82% in a non hazardous diluent
Ethyl acetate, for HPLC, >=99.8% (GC)
Ethyl acetate, ACS, 99.5% min. 500ml
Ethyl acetate, HPLC, UV-IR min. 99.9 %, isocratic grade
Ethyl acetate, suitable for 300 per JIS, >=99.5%, for residue analysis
Ethyl acetate, suitable for 1000 per JIS, >=99.5%, for residue analysis
Ethyl acetate, HPLC Plus, for HPLC, GC, and residue analysis, 99.9%
Ethyl acetate, puriss. p.a., ACS reagent, >=99.5% (GC)
Ethyl acetate, puriss. p.a., free of higher boiling impurities, >=99.9% (GC)
ACETIC-2,2,2-D3 ACID,ETHYL-1,1,2,2,2-D5 ESTER
InChI=1/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H
Ethyl acetate, puriss., meets analytical specification of Ph. Eur., BP, NF, >=99.5% (GC)
Ethyl acetate, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.5% (GC)
IUPAC nameethyl acetate
SMILESCCOC(=O)C
InchiInChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
FormulaCH3COOC2H5
PubChem ID8857
Molweight88.106
LogP0.28
Atoms14
Bonds13
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationEsters

mVOC Specific Details

Volatilization
The Henry's Law constant for ethyl acetate is 1.34X10-4 atm-cu m/mole(1). This Henry's Law constant indicates that ethyl acetate is expected to volatilize from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 9 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 6 days(SRC). Ethyl acetate's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Ethyl acetate is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 93.2 mm Hg(3).
Literature: (1) Meylan WM, Howard PH; Environ Toxicol Chem 10: 1283-93 (1991) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of Jun 25, 2014: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (4) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis, (1991)
Soil Adsorption
The Koc of ethyl acetate is estimated as 18(SRC), using a log Kow of 0.73(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that ethyl acetate is expected to have very high mobility in soil(SRC). A log Ki (snow surface/air (cu m/sq m)) of -3.69 has been reported for sorption to snow(4).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR (consult ed) Washington,DC: Amer Chem Soc p. 9 (1995) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of Jun 25, 2014: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (3) Swann RL et al; Res Rev 85: 23 (1983) (4) Roth CM et al; Environ Sci Technol 38: 4078-4084 (2004)
Vapor Pressure
PressureReference
93.2 mm Hg at 25 deg CDaubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis, (1991)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber SimoneaNoneNone March et al., 2006
FungiTuber Aestivumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Melanosporumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiTuber Rufumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Simonean/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTrichodema Pseudokoningiin/aWheatley et al., 1997
FungiTrichodema Viriden/aWheatley et al., 1997
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaEscherichia Colin/aHettinga et al., 2008
BacteriaLeuconostoc Citreum CIRM1455nagoat cheese wheyPogačić et al., 2016
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStaphylococcus Aureusn/aHettinga et al., 2008
BacteriaStreptococcus Dysgalactiaen/aHettinga et al., 2008
BacteriaStreptococcus Uberisn/aHettinga et al., 2008
FungiAscocoryne Sarcoides NRRL 50072n/aMallette et al. 2012
FungiCandida Shehataecacti, fruits, insects, natural habitatsNout and Bartelt 1998
Fungi Ceratocystis FagacearumLin and Phelan 1994
FungiCeratocystis Sp.Enhanced growth and sporulation of Pestalotia rhododendri at low concentrations. Inhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiDipodascus AggregatusEnhanced growth and sporulation of Pestalotia rhododendri at low concentrations. Inhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiGeotrichum Candidumcompost mixed with milky fermented productZirbes et al. 2011
FungiMuscodor Crispansn/aMitchell et al., 2010
FungiNeurospora Sitophila ATCC 46892n/aPastore et al.,1994
FungiNeurospora Sp.n/aPastore et al., 1994
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPenicillium DigitatumSchnürer et al. 1999
FungiPichia AnomalaSchnürer et al. 1999
FungiSaccharomyces CerevisiaeEnhanced growth and sporulation of Pestalotia rhododendri at low concentrations. Inhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiSaccharomyces Cerevisiae CR1control citrus black spot disease fermentation processesToffano et al. 2017
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
FungiThielaviopsis BasicolaEnhanced growth and sporulation of Pestalotia rhododendri at low concentrations. Inhibited growth and sporulation of Aspergillus niger.Stotzky and Schenk, 1976
FungiTuber Aestivumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber BorchiiT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber SimoneaNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Aestivumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Melanosporumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiTuber Rufumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Simonean/aPressure balanced head-space sampling and GC/TOF-MS
FungiTrichodema PseudokoningiiLow mediumGC/MS
FungiTrichodema VirideLow mediumGC/MS
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaEscherichia ColiMilkHS-SPME/GC-MS
BacteriaLeuconostoc Citreum CIRM1455curd-based broth mediumGC/MSYes
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStaphylococcus AureusMilkHS-SPME/GC-MS
BacteriaStreptococcus DysgalactiaeMilkHS-SPME/GC-MS
BacteriaStreptococcus UberisMilkHS-SPME/GC-MS
FungiAscocoryne Sarcoides NRRL 50072Minimal mediumPTR-MS and SPME GC-MS
FungiCandida Shehataeyeast malt agarSPME, GC-MSyes
Fungi Ceratocystis Fagacearumno
FungiCeratocystis Sp.n/an/a
FungiDipodascus Aggregatusn/an/a
FungiGeotrichum Candidummedium 863SPME-GC-MSyes
FungiMuscodor Crispanspotato dextrose agarSPME-GC-MS
FungiNeurospora Sitophila ATCC 46892Malt extractHeadspace/gas chromatography
FungiNeurospora Sp.potato dextrose agardynamic headspace/gas chromatography
FungiPenicillium Commune PittMEAGC/MS
FungiPenicillium Digitatummalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiPichia Anomalamalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiSaccharomyces Cerevisiaen/an/a
FungiSaccharomyces Cerevisiae CR1YEPDAGC/MSno
FungiSaccharomyces Cerevisiae Y1001n/an/a
FungiThielaviopsis Basicolan/an/a
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
FungiTuber BorchiiYes


3-methylbutanoic Acid

Mass-Spectra

Compound Details

Synonymous names
Isovaleriansaeure
Isovalericacid
Isovalerianic
Isobutylformic acid
Isopropylacetic acid
isovalerate
Kyselina isovalerova
METHYLBUTANOIC ACID
GWYFCOCPABKNJV-UHFFFAOYSA-N
Isopentanoic acid
Isovalerianic acid
3-Methylbuttersaeure
b-Methylbutyrate
ISOVALERIC ACID
beta-Methylbutyric acid
Delphinic acid
NATURAL ISOVALERIC ACID
3-Methylbutyrate
b-Methylbutyric acid
Isobutyl formic acid
IVA
methyl butanoic acid
3-Methylbutyric
Isovaleric acid, analytical standard
3-Methylbutanoic acid
3-Methylbutyric acid|
iso-valeric acid
3-Methylbutyric acid
ACMC-1BMPI
Isopropyl Acetic Acid, natural
AC1L1V6N
iso-C4H9COOH
Kyselina isovalerova [Czech]
Methylbutanoic acid (Related)
3-methyl-butanoic acid
3,4-Diisovaleryl adrenaline
.beta.-Methylbutyric acid
3-methyl butyric acid
3-methyl-butyric acid
3-Methylbutyric acid: isopropyl-Acetate
AC1Q1P73
Isovaleric acid (natural)
KSC489M7P
S153
Acetic acid, isopropyl-
SCHEMBL43436
3-Methylbutyric acid: isopropyl-Acetic acid
CTK3I9677
HMDB00718
HSDB 629
3-methyl-n-butyric acid
CHEMBL568737
DB03750
Isovaleric acid, 99%
NSC62783
RP18769
STR08356
1BR7X184L5
bmse000373
C08262
ZINC388188
AK116943
BBL027399
BC677309
DTXSID5029182
LS-2386
OR025022
OR111348
OR376668
OR376669
STL146358
WLN: QV1Y1&1
CHEBI:28484
DSSTox_CID_9182
UNII-1BR7X184L5
AJ-20479
AN-21437
ANW-30978
Butanoic acid, 3-methyl-
DSSTox_GSID_29182
Isovaleric acid sodium salt (Salt/Mix)
KB-52997
NSC 62783
NSC-62783
SC-27287
TRA0072843
BB_NC-2309
Butyric acid, 3-methyl-
DSSTox_RID_78698
LMFA01020181
MFCD00002726
AI3-24132
FEMA Number: 3102
RTR-018005
ST24028594
TR-018005
AKOS000119861
J-522594
BRN 1098522
FEMA No. 3102
FT-0627533
I14-10601
Z955123492
Isovaleric acid, natural, >=98%, FG
Tox21_201604
503-74-2
F2191-0067
NA 1760 (Related)
Isovaleric acid, >=99%, FCC, FG
MCULE-5805071360
NCGC00249082-01
NCGC00259153-01
CAS-503-74-2
EINECS 207-975-3
35915-22-1
7050-EP2286915A2
7050-EP2287153A1
7050-EP2289892A1
7050-EP2292590A2
7050-EP2295417A1
7050-EP2301934A1
7050-EP2305656A1
7050-EP2305675A1
7050-EP2308509A1
7050-EP2308828A2
7050-EP2308848A1
7050-EP2308872A1
7050-EP2314585A1
7050-EP2316829A1
7050-EP2374791A1
MolPort-000-871-620
31567-EP2275401A1
31567-EP2277861A1
31567-EP2298763A1
31567-EP2308858A1
31567-EP2311816A1
31567-EP2311817A1
31567-EP2374790A1
66994-EP2298772A1
66994-EP2308839A1
Butanoic acid, 3-methyl-, (R)-
4-02-00-00895 (Beilstein Handbook Reference)
InChI=1/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7
IUPAC name3-methylbutanoic acid
SMILESCC(C)CC(=O)O
InchiInChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)
FormulaC5H10O2
PubChem ID10430
Molweight102.133
LogP1.21
Atoms17
Bonds16
H-bond Acceptor2
H-bond Donor1
Chemical ClassificationAcids carboxylic acids esters

mVOC Specific Details

Boiling Point
DegreeReference
176.5 °CPhysProp
176.5 DEG C @ 760 MM HGLide, D.R. (ed.). CRC Handbook of Chemistry and Physics. 76th ed. Boca Raton, FL: CRC Press Inc., 1995-1996., p. 3-98
Volatilization
The Henry's Law constant for isovaleric acid was measured as 8.33X10-7 atm-cu m/mole(1). This value indicates that isovaleric acid will volatilize slowly from water surfaces(2,SRC). Based on this Henry's Law constant, the estimated volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec) is estimated as approximately 45 days(2,SRC). The estimated volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec) is estimated as approximately 330 days(2,SRC). In addition, a pKa of 4.78 for isovaleric acid(3) indicates that isovaleric acid will not significantly volatilize from water as it will exist predominately in the ionic form under environmental pHs(SRC). Isovaleric acid's Henry's Law constant(1) indicates that volatilization from moist soil surfaces may occur(SRC). Isovaleric acid is not expected to volatilize from dry soil surfaces(SRC) based on a measured vapor pressure of 0.44 mm Hg(4).
Literature: (1) Khan I, Brimblecombe P; J Aerosol Sci 23: S897-S900 (1992) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington,DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Leung HW, Paustenbach DJ; Am J Ind Med 18: 714-23 (1990) (4) Yaws CL; Handbook of Vapor Pressure, Vol 2 C5 to C7 Compounds, Houston,TX: Gulf Publ Co. p. 387 (1994)
Soil Adsorption
The Koc of isovaleric acid is estimated as approximately 100(SRC), using a measured log Kow of 1.16(1) and a regression-derived equation(2,SRC). According to a recommended classification scheme(3), this estimated Koc value suggests that isovaleric acid is expected to have high mobility in soil(SRC).
Literature: (1) Hansch C et al; Exploring QSAR. Hydrophobic, Electronic, and Steric Constants. ACS Prof Ref Book. Heller SR (consult ed) Washington, DC: Amer Chem Soc p. 14 (1995) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 4-9 (1990) (3) Swann RL et al; Res Rev 85: 23 (1983)
Vapor Pressure
PressureReference
0.44 mm Hg at 25 deg CYaws CL; Handbook of Vapor Pressure, Vol 2 C5 to C7 Compounds, Houston, TX: Gulf Publishing Co. p. 387 (1994)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaKlebsiella Pneumoniaen/aJulak et al., 2003
BacteriaStaphylococcus Aureusn/aJulak et al., 2003
BacteriaStaphylococcus Aureusmilk of cowsHettinga et al 2010
BacteriaEscherichia Coli O157:H7China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
BacteriaStaphylococcus Aureus ATCC 6538China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
BacteriaBurkholderia Andropogonis LMG 2129n/aBlom et al., 2011
BacteriaBurkholderia Anthina LMG 20980n/aBlom et al., 2011
BacteriaBurkholderia Caledonica LMG 19076n/aBlom et al., 2011
BacteriaBurkholderia Caribensis LMG 18531n/aBlom et al., 2011
BacteriaBurkholderia Caryophylli LMG 2155n/aBlom et al., 2011
BacteriaBurkholderia Fungorum LMG 16225n/aBlom et al., 2011
BacteriaBurkholderia Gladioli LMG 2216n/aBlom et al., 2011
BacteriaBurkholderia Glathei LMG 14190n/aBlom et al., 2011
BacteriaBurkholderia Glumae LMG 2196n/aBlom et al., 2011
BacteriaBurkholderia Graminis LMG 18924n/aBlom et al., 2011
BacteriaBurkholderia Lata LMG 22485n/aBlom et al., 2011
BacteriaBurkholderia Pyrrocinia LMG 21822n/aBlom et al., 2011
BacteriaBurkholderia Xenovorans LMG 21463n/aBlom et al., 2011
BacteriaCellulomonas Udan/aBlom et al., 2011
BacteriaEscherichia Colin/aTait et al., 2014
BacteriaEscherichia Coli OP50n/aBlom et al., 2011
BacteriaKlebsiella Pneumoniaen/aTait et al., 2014
BacteriaLactobacillus Paracasei LSL 248nanaPogačić et al., 2016
BacteriaPseudomonas Chlororaphisn/aBlom et al., 2011
BacteriaSalinispora Tropica CNB-440namarine sedimentGroenhagen et al., 2016
BacteriaSerratia Plymuthica IC14n/aBlom et al., 2011
BacteriaStaphylococcus Aureusn/aTait et al., 2014
BacteriaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
BacteriaStaphylococcus Sciuriattract Episyrphus balteatusfrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al., 2011
BacteriaStaphylococcus Xylosusn/aSchulz and Dickschat, 2007
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
BacteriaStigmatella Aurantiaca DW4/3-1n/aDickschat et al., 2005_5
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaCorynebacterium Striatum RV2clinical isolateLemfack et al. 2016
BacteriaCorynebacterium Striatum V6894clinical isolateLemfack et al. 2016
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaStaphylococcus Epidermidis ATCC 12228Lemfack et al. 2016
BacteriaStaphylococcus Epidermidis ATCC 14990clinical isolate,noseLemfack et al. 2016
BacteriaStaphylococcus Epidermidis DSM 3269clinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Epidermidis RP62Aclinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Haemolyticus CCM 2729clinical isolate,human skinLemfack et al. 2016
BacteriaStaphylococcus Intermedius 9Sclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Saccharolyticus B5709clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi DSMZ 4807clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi H34clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Schleiferi V431clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri ATCC 29061Southernflying squirrel skinLemfack et al. 2016
BacteriaStaphylococcus Sciuri H4286clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri ORclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri V405clinical isolateLemfack et al. 2016
BacteriaStaphylococcus Sciuri Yclinical isolateLemfack et al. 2016
BacteriaStaphylococcus Warneri CCM 2730clinical isolate,human skinLemfack et al. 2016
BacteriaStreptomycesJones et al. eLife 2017;6:e21738.
FungiAscocoryne Sarcoides NRRL 50072n/aMallette et al. 2012
BacteriaBacteroides FragilisReduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
BacteriaVeillonella Spp.Reduction of heat resistant spores, prevention of spore formation of Salmonella typhimurium, Salmonella enteritidis, Escherichia coli, Pseudomonas aeroginosa, Clostridium perfringenes and Clostridium difficile.Hinton and Hume, 1995
BacteriaActinomyces Europaeusclinical exudatesJulak et al. 2003
BacteriaActinomyces Naeslundiiclinical exudatesJulak et al. 2003
BacteriaAzospirillum Brasilense Cdpromotion of performance of Chlorella sorokiniana Shihculture collection DSMZ 1843Amavizca et al. 2017
BacteriaBacillus Pumilus ES4promotion of performance of Chlorella sorokiniana ShihAmavizca et al. 2017
BacteriaBacteroides Capillosusclinical exudatesJulak et al. 2003
BacteriaBacteroides Distasonisn/aWiggins et al., 1985
BacteriaBacteroides Fragilisclinical exudatesJulak et al. 2003
BacteriaBacteroides Ovatusn/aWiggins et al., 1985
BacteriaBacteroides Pyogenesclinical exudatesJulak et al. 2003
BacteriaBacteroides Thetaiotamicronn/aWiggins et al., 1985
BacteriaBacteroides Vulgatusn/aWiggins et al., 1985
BacteriaCapnocytophaga Ochracea ATCC 33596n/aKurita-Ochiai et al., 1995
BacteriaClostridium Bifermentansn/aWiggins et al., 1985
BacteriaClostridium Difficileclinical exudatesJulak et al. 2003
BacteriaClostridium Perfringensclinical exudatesJulak et al. 2003
BacteriaClostridium Ramosumclinical exudatesJulak et al. 2003
BacteriaClostridium Septicumclinical exudatesJulak et al. 2003
BacteriaClostridium Sp.n/aStotzky and Schenk, 1976
BacteriaClostridium Sporogenesn/aWiggins et al., 1985
BacteriaEubacterium Lentumclinical exudatesJulak et al. 2003
BacteriaFusobacterium NucleatumInhibition of proliferation and cytokine production in Lymphocyte cells.Kurita-Ochiai et al., 1995
BacteriaFusobacterium Simiaeclinical exudatesJulak et al. 2003
BacteriaLactobacillus Acidophilusclinical exudatesJulak et al. 2003
BacteriaPeptococcus Nigerclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Anaerobicusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Asaccharolyticusclinical exudatesJulak et al. 2003
BacteriaPeptostreptococcus Prevotiiclinical exudatesJulak et al. 2003
BacteriaPorphyromonas GingivalisInhibition of proliferation and cytokine production in Lymphocyte cells.Kurita-Ochiai et al., 1995
BacteriaPorphyromonas Gingivalis FDC381n/aKurita-Ochiai et al., 1995
BacteriaPorphyromonas Gingivalis W83n/aKurita-Ochiai et al., 1995
BacteriaPrevotella Intermedia ATCC 25261n/aKurita-Ochiai et al., 1995
BacteriaPrevotella LoescheiiInhibition of proliferation and cytokine production in Lymphocyte cells.Kurita-Ochiai et al., 1995
BacteriaPrevotella Loescheii ATCC 15930n/aKurita-Ochiai et al., 1995
BacteriaPropionibacterium Acnesclinical exudatesJulak et al. 2003
BacteriaPropionibacterium Propionicumclinical exudatesJulak et al. 2003
BacteriaStaphylococcus Epidermidisclinical exudatesJulak et al. 2003
FungiAgaricus BisporusStimulation of spore germination of Agaricus bisporus.Stotzky and Schenk, 1976
FungiAspergillus Ustusnawater damaged buildings, BelgiumPolizzi et al., 2012
Fungi Muscodor AlbusEzra et al. 2005
FungiPenicillium Polonicumnawater damaged buildings, BelgiumPolizzi et al., 2012
Fungi Penicillium SppEzra et al. 2005
Fungi Polysporus SulfureusEzra et al. 2005
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaKlebsiella PneumoniaeVF (peptone, NaCl) and VL broth (casein hydrolysate, yeast extract, beef extract, cysteine, glucose, NaCl)HS-SPME/GC-MS
BacteriaStaphylococcus AureusVF (peptone, NaCl)HS-SPME/GC-MS
BacteriaStaphylococcus AureusGCMS DSQno
BacteriaEscherichia Coli O157:H7Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
BacteriaStaphylococcus Aureus ATCC 6538Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
FungiSaccharomyces Cerevisiae Y1001n/an/a
BacteriaBurkholderia Andropogonis LMG 2129MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Anthina LMG 20980MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caledonica LMG 19076MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caribensis LMG 18531MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Caryophylli LMG 2155MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Fungorum LMG 16225MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Gladioli LMG 2216MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Glathei LMG 14190MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Glumae LMG 2196MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Graminis LMG 18924MR-VPHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Lata LMG 22485MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Pyrrocinia LMG 21822MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaBurkholderia Xenovorans LMG 21463AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaCellulomonas UdaMR-VP and MS Headspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaEscherichia ColiBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Column
BacteriaEscherichia Coli OP50MR-VP, MS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaKlebsiella PneumoniaeBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Column
BacteriaLactobacillus Paracasei LSL 248curd-based broth mediumGC/MSYes
BacteriaPseudomonas ChlororaphisMS and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaSalinispora Tropica CNB-440seawater-based A1GC/MS
BacteriaSerratia Plymuthica IC14MR-VP and AngleHeadspace air was trapped in glass Gerstel TDS tubes and analysed by gas chromatography with mass selective detection (GC-MSD)
BacteriaStaphylococcus AureusBHI Broth/ TS Broth/Glucose EF base brothGC-MS /Polar GC Column
BacteriaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
BacteriaStaphylococcus Sciuri873 liquid mediumSPME-GC/MS
BacteriaStaphylococcus Xylosusn/an/a
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
BacteriaStigmatella Aurantiaca DW4/3-1n/an/a
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaCorynebacterium Striatum RV2brain heart infusion mediumPorapak / GC/MSno
BacteriaCorynebacterium Striatum V6894brain heart infusion mediumPorapak / GC/MSno
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
BacteriaStaphylococcus Epidermidis ATCC 12228brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis ATCC 14990brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis DSM 3269brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis RP62Abrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Haemolyticus CCM 2729brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Intermedius 9Sbrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Saccharolyticus B5709brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi DSMZ 4807brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi H34brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Schleiferi V431brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri ATCC 29061brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri H4286brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri ORbrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri V405brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Sciuri Ybrain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Warneri CCM 2730brain heart infusion mediumPorapak / GC/MSno
BacteriaStreptomycesYPD agarGCxGC-TOFMSno
FungiAscocoryne Sarcoides NRRL 50072Minimal mediumPTR-MS and SPME GC-MS
BacteriaBacteroides Fragilisn/an/a
BacteriaVeillonella Spp.n/an/a
BacteriaActinomyces Europaeuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaActinomyces Naeslundiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaAzospirillum Brasilense CdTSASPME-GCno
BacteriaBacillus Pumilus ES4TSASPME-GCno
BacteriaBacteroides Capillosuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Distasonisn/an/a
BacteriaBacteroides Fragilispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Ovatusn/an/a
BacteriaBacteroides Pyogenespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaBacteroides Thetaiotamicronn/an/a
BacteriaBacteroides Vulgatusn/an/a
BacteriaCapnocytophaga Ochracea ATCC 33596n/an/a
BacteriaClostridium Bifermentansn/an/a
BacteriaClostridium Difficilepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Perfringenspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Ramosumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Septicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaClostridium Sp.n/an/a
BacteriaClostridium Sporogenesn/an/a
BacteriaEubacterium Lentumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaFusobacterium Nucleatumn/an/a
BacteriaFusobacterium Simiaepeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaLactobacillus Acidophiluspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptococcus Nigerpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Anaerobicuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Asaccharolyticuspeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPeptostreptococcus Prevotiipeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPorphyromonas Gingivalisn/an/a
BacteriaPorphyromonas Gingivalis FDC381n/an/a
BacteriaPorphyromonas Gingivalis W83n/an/a
BacteriaPrevotella Intermedia ATCC 25261n/an/a
BacteriaPrevotella Loescheiin/an/a
BacteriaPrevotella Loescheii ATCC 15930n/an/a
BacteriaPropionibacterium Acnespeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaPropionibacterium Propionicumpeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
BacteriaStaphylococcus Epidermidispeptone/casein hydrolysate, yeast extract, beef extract, glucoseGC-FID FSOT NUKOLyes
FungiAgaricus Bisporusn/an/a
FungiAspergillus Ustusmalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
Fungi Muscodor Albusno
FungiPenicillium Polonicummalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
Fungi Penicillium Sppno
Fungi Polysporus Sulfureusno


3-methylbutanal

Mass-Spectra

Compound Details

Synonymous names
Isovalerylaldehyde
ISOVALERALDEHYDE
Aldehyde isovalerianique
beta-Methylbutyraldehyde
Isoamylaldehyde
Isopentaldehyde
ISOVALERALDEHYDE,TECH
Isopentanal
Isovaleral
Isovaleraldehyde, analytical standard
Isovaleric aldehyde
beta-Methylbutanal
Iso-Valeraldehyde
YGHRJJRRZDOVPD-UHFFFAOYSA-N
3-Methylbutylaldehyde
3-Methylbutyraldehyde
b-Methylbutanal
Isoamyl aldehyde
Methyl butanal
3-Methylbutanal
3-Methyl butyraldehyde
3-methyl-Butyraldehyde
AC1L1XLJ
ACMC-1ATPF
Aldehyde isovalerianique [French]
.beta.-Methylbutanal
3-methyl butanal
3-Methyl-Butanal
AC1Q1P7B
iso-C4H9CHO
Isovaleraldehyde, 97%
3-Methylbutyraldehyde (natural)
2-Methylbutanal-4
Butanal, methyl-
KSC270C4R
CHEMBL18360
CTK1H0148
HMDB06478
HSDB 628
I0192
Z4917
Butyraldehyde, 3-methyl-
RP18454
3-Methyl-1-butanal
3-Methylbutan-1-al
C07329
CCRIS 2945
Isovaleraldehyde, >=97%, FG
ZINC896832
AK130482
BBL027631
DTXSID1021619
LS-2913
MP-2148
NSC404119
OR000198
OR111347
OR290748
STL146355
WLN: VH1Y1&1
Butanal, 3-methyl-
CHEBI:16638
DSSTox_CID_1619
69931RWI96
AN-21530
ANW-33143
CJ-04498
DSSTox_GSID_21619
EBD2211673
KB-77969
SC-27291
TRA0100272
BB_NC-2289
BDBM50028832
DSSTox_RID_76239
Isovaleraldehyde, natural, >=95%, FG
MFCD00007014
ZINC00896832
AI3-16106
NSC 404119
NSC-404119
RTR-030709
TR-030709
UNII-69931RWI96
AKOS000118930
I14-2596
J-512894
BRN 0773692
FEMA No. 2692
FT-0627530
1-Butanal, 3-methyl-
Tox21_200891
590-86-3
F2190-0631
NCGC00248867-01
NCGC00258445-01
CAS-590-86-3
EINECS 209-691-5
6398-EP2374783A1
6398-EP2377841A1
6398-EP2380871A1
MolPort-001-787-528
ISOVALERALDEHYDE, B.P.91-93<144>
4-01-00-03291 (Beilstein Handbook Reference)
InChI=1/C5H10O/c1-5(2)3-4-6/h4-5H,3H2,1-2H
IUPAC name3-methylbutanal
SMILESCC(C)CC=O
InchiInChI=1S/C5H10O/c1-5(2)3-4-6/h4-5H,3H2,1-2H3
Formula(CH3)2CHCH2CHO
PubChem ID11552
Molweight86.134
LogP1.05
Atoms16
Bonds15
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationAldehydes

mVOC Specific Details

Volatilization
The Henry's Law constant for 3-methylbutanal is estimated as 4.0X10-4 atm-cu m/mole(SRC) derived from its vapor pressure, 50 mm Hg(1), and water solubility, 1.4X10+4 mg/L(2). This Henry's Law constant indicates that 3-methylbutanal is expected to volatilize rapidly from water surfaces(3). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(3) is estimated as 5 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(3) is estimated as 4 days(SRC). 3-Methylbutanal's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of 3-methylbutanal from dry soil surfaces may exist(SRC) based upon its vapor pressure(1).
Literature: (1) Clayton GD, Clayton FE; Patty's Industrial Hygiene and Toxicology Volume III 2nd ed 3A: The Work Environment NY,NY: John Wiley Sons p. 2638 (1985) (2) Falbe J, Lappe P; in Ullmann's Encycl Indust Chem 5th ed. Gerhartz W, ed Deerfield Beach, FL: VCH Publishers A1: 321-52 (1985) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)
Soil Adsorption
The Koc of 3-methylbutanal is estimated as 23(SRC), using a water solubility of 1.4X10+4 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 3-methylbutanal is expected to have very high mobility in soil.
Literature: (1) Falbe J, Lappe P; in Ullmann's Encycl Indust Chem 5th ed. Gerhartz W, ed Deerfield Beach, FL: VCH Publishers A1: 321-52 (1985) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 4-5 (1990) (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
50 mm Hg at approx 25 deg CClayton, G. D. and F. E. Clayton (eds.). Patty's Industrial Hygiene and Toxicology: Volume 2A, 2B, 2C: Toxicology. 3rd ed. New York: John Wiley Sons, 1981-1982., p. 2638
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaSerratia Spp. B2675n/aBruce et al., 2004
BacteriaSerratia Spp. B675n/aBruce et al., 2004
FungiSaccharomyces Cerevisiae Y1001n/aBruce et al., 2004
BacteriaCoagulase Negative Staphylococcimilk of cowsHettinga et al 2010
BacteriaEscherichia Colimilk of cowsHettinga et al 2010
BacteriaL Isteria Monocytogenesn/aArnold and Senter, 1998
BacteriaStaphylococcus Aureusmilk of cowsHettinga et al 2010
BacteriaStreptococcus Dysgalactiaemilk of cowsHettinga et al 2010
FungiTuber AestivumBurgundy regionMolinier et al., 2015
BacteriaStaphylococcus Aureus ATCC 6538China Center of Industrial culture Collection, China General Microbiological Culture Collection CenterChen et Al. 2016
FungiTuber Aestivumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
BacteriaCitrobacter FreundiiAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaKlebsiella PneumoniaeAmerican Type Culture Collection Robacker and Bartelt 1997
BacteriaLactobacillus Helveticus CIRM449nayoghurtPogačić et al., 2016
BacteriaStaphylococcus Aureusn/aJia et al., 2010
BacteriaStaphylococcus EpidermidisDSMZVerhulst et al. 2010
BacteriaStaphylococcus Sciurinafrom the gut flora of pea aphid Acyrthosiphon pisum honeydewLeroy et al., 2011
BacteriaStaphylococcus Sp.n/aSchulz and Dickschat, 2007
FungiFusarium Graminearum 15AcDONn/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON 1001tan/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON ZFR 29n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_4n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_5n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_6n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_7n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_8n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_9n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1002tn/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 11791n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1509n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 8046n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL38369n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL6394n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 15n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 37n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 51n/aBusko et al., 2014
FungiFusarium Graminearum NIVn/aBusko et al., 2014
FungiFusarium Graminearum NIV 357n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 119n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 23n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 48n/aBusko et al., 2014
FungiFusarium Graminearum NIV_5n/aBusko et al., 2014
FungiFusarium Graminearum NIV_6n/aBusko et al., 2014
FungiFusarium Graminearum NIV_7n/aBusko et al., 2014
FungiFusarium Graminearum NIV_8n/aBusko et al., 2014
FungiTrichoderma VirideHung et al., 2013
FungiTuber Aestivumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Borchiin/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Excavatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Indicumn/aSplivallo et al., 2007
FungiTuber Magnatumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aSplivallo et al., 2007
FungiTuber Mesentericumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Oligospermumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Panniferumn/aProf. Mattia Bentivenga (Università di Perugia, Perugia, Italy) and in the fortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Uncinatumn/aFrance, Italy, Switzerland, the UK, Austria, Romania, and HungarySplivallo et al., 2012
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Miesentericum March et al., 2006
FungiMuscodor Albus CZ-620n/aCorcuff et al., 2011
Fungi Aspergillus Sp.Jelen and Grabarkiewicz-Szczesna 2006
Fungi Fusarium Sp.Jelen and Grabarkiewicz-Szczesna 2006
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaSerratia Spp. B2675n/an/a
BacteriaSerratia Spp. B675n/an/a
FungiSaccharomyces Cerevisiae Y1001n/an/a
BacteriaCoagulase Negative StaphylococciGCMS DSQno
BacteriaEscherichia ColiGCMS DSQno
BacteriaL Isteria MonocytogenesHS-SPME/GC-MS
BacteriaStaphylococcus AureusGCMS DSQno
BacteriaStreptococcus DysgalactiaeGCMS DSQno
FungiTuber AestivumHS-SPME/GC-MS Yes
BacteriaStaphylococcus Aureus ATCC 6538Trypticase Soy Broth (TSB)HS-SPME/'GC-MSno
FungiTuber Aestivumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
FungiTuber Melanosporumn/aHeadspace solid-phase microextraction (HS-SPME) combined with GC-MS
BacteriaCitrobacter Freundiitryptic soy broth SPME, GC-MSyes
BacteriaKlebsiella Pneumoniaetryptic soy broth SPME, GC-MSyes
BacteriaLactobacillus Helveticus CIRM449curd-based broth mediumGC/MSYes
BacteriaStaphylococcus AureusMueller Hinton brothHS-SPME/GC-MS
BacteriaStaphylococcus EpidermidisCLSA, charcoal, GC-MSno
BacteriaStaphylococcus Sciuri865 liquid mediumSPME-GC/MS
BacteriaStaphylococcus Sp.n/an/a
FungiFusarium Graminearum 15AcDONyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON 1001tayeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON ZFR 29yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_4yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_9yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1002tyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 11791yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1509yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 8046yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL38369yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL6394yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 15yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 37yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 51yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIVyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV 357yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 119yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 23yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 48yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_8yeast extract sucrose agarSPME/GC-MS
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSYes
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Indicumn/an/a
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/an/a
FungiTuber Mesentericumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Oligospermumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Panniferumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Uncinatumn/aSPME-GC-MS
BacteriaBacillus Amyloliquefaciens IN937aTryptic soy agarSPME coupled with GC-MS
BacteriaBacillus Subtilis GB03Tryptic soy agarSPME coupled with GC-MS
BacteriaPaenibacillus Polymyxa E681Tryptic soy agarSPME coupled with GC-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumPressure balanced head-space sampling and GC/TOF-MSNo
FungiMuscodor Albus CZ-620n/aHeadspace sampler/GC-MS
Fungi Aspergillus Sp.no
Fungi Fusarium Sp.no


(methyldisulfanyl)methane

Mass-Spectra

Compound Details

Synonymous names
Methyldisulfanylmethane
Methyldithiomethane
dimethyldisulphide
Dimethyldisulfide
methyldisulfanyl methane
Methyldisulfide
Dimethyl disulphide
WQOXQRCZOLPYPM-UHFFFAOYSA-N
Dimethyl disulfide
methyl disulphide
Disulfide dimethyl
METHYL DISULFIDE
(Methyldisulfanyl)methane
DMDS
Sulfa-hitech
Dimethyl disulfide, analytical standard
(Methyldithio)methane
(Methyldisulfanyl)methane #
Disulfide, dimethyl
AC1Q4HER
AC1Q4HEQ
1,2-Dimethyldisulfane
PubChem9665
Dimethyl disulfide, >=99%
AC1L1Z53
2,3-Dithiabutane
Dimethyl disulfide, 99%
NSC9370
UN2381
Dimethyl disulfide, 98%
HMDB05879
D0714
CTK2F3131
RP18575
CHEBI:4608
CCRIS 2939
C08371
BDBM233038
Methyl disulfide (8CI)
WLN: 1SS1
3P8D642K5E
HSDB 6400
LS-1499
DTXSID4025117
NSC 9370
NSC-9370
OR000230
OR291634
CHEMBL1347061
Sulfa-hitech 0382
UN 2381
(1/4)x>>u paragraph signthornAoAN
(CH3S)2
UNII-3P8D642K5E
ZINC8221057
A833808
Dimethyl disulfide, >=99.0%
DSSTox_CID_5117
KB-76616
AN-22028
TL8004165
Dimethyl disulfide, >=98%, FG
DSSTox_GSID_25117
DSSTox_RID_77673
MFCD00008561
AI3-25305
TR-021489
RTR-021489
I09-0129
Q-100719
AKOS009157459
FEMA No. 3536
FT-0625135
METHYL, [(THIOMETHYL)THIO]-
Dimethyl disulfide, natural, >=98%, FG
EN300-36043
Tox21_201525
F0001-1676
624-92-0
NCGC00259075-01
NCGC00091798-02
NCGC00091798-01
MCULE-7451882535
EINECS 272-923-9
CAS-624-92-0
Dimethyl disulfide [UN2381] [Flammable liquid]
EINECS 210-871-0
Dimethyl disulfide [UN2381] [Flammable liquid]
MolPort-003-929-787
Dimethyl disulfide, purum, >=98.0% (GC)
224638-EP2371831A1
InChI=1/C2H6S2/c1-3-4-2/h1-2H
IUPAC name(methyldisulfanyl)methane
SMILESCSSC
InchiInChI=1S/C2H6S2/c1-3-4-2/h1-2H3
FormulaC2H6S2
PubChem ID12232
Molweight94.19
LogP1.35
Atoms10
Bonds9
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationSulfides Sulfide thioethers sulfur compounds

mVOC Specific Details

Volatilization
The Henry's Law constant for dimethyl disulfide is reported as 1.21X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that dimethyl disulfide is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3.5 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 4.1 days(SRC). Dimethyl disulfide's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). In a laboratory study, the volatilization rate of dimethyl disulfide from a tidal marsh soil (at field capacity or 1.5 field capacity) ranged from 0.1 to 0.4 ng (sulfur basis)/min(3). Dimethyl disulfide is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 28.7 mm Hg(4).
Literature: (1) Vitenberg AG et al; J Chromatography 112: 319-27 (1975) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Farwell SO et al; Soil Biol Biochem 11: 411-5 (1979) (4) Daubert TE, Danner RP; Physical & Thermodynamic Properties of Pure Chemicals: Data Compilation. New York, NY: Hemisphere Pub Corp (1989)
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of dimethyl disulfide can be estimated to be 40(SRC). According to a classification scheme(2), this estimated Koc value suggests that dimethyl disulfide is expected to have very high mobility in soil. Gas chromatographic studies with various air-dry and moist soils have shown that soil can sorb atmospheric, gas phase dimethyl disulfide(3). In one closed-system test, 17-94% of input dimethyl disulfide was sorbed by the soil in 10 min(3); in a 15-day test, dimethyl disulfide sorption was 101-306 ug sorbed/g soil(3). Soil microbes were found to be important for the gas phase sorption of dimethyl disulfide as 15-day sorption in sterilized soil was only 9-98 ug sorbed/g soil(3).
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Jan, 2011. Available from, as of Nov 7, 2013: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Swann RL et al; Res Rev 85: 17-28 (1983) (3) Bremner JM, Banwart WL; Soil Biol Biochem 8: 79-83 (1976)
Vapor Pressure
PressureReference
28.7 mm Hg at 25 deg CDaubert, T.E., R.P. Danner. Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1989.
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaStreptomyces Alboflavus TD-1n/aWang et al., 2013
BacteriaAchromobacter Xylosoxidans AF411019Nematicidal activitycow dungXU et al., 2015
BacteriaActinomycetes Spp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaAeromonas VeroniiThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaAlcaligenes Faecalisn/aZou et al., 2007
BacteriaAlcaligenes Spp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaAMI 386nabreathing zone of a waste collection workerWilkins, 1996
BacteriaArthrobacter Nicotianae JQ071518Nematicidal activitycow dungXU et al., 2015
BacteriaArthrobacter Nitroguajacoliusn/aZou et al., 2007
BacteriaBacillus Amyloliquefaciens IN937an/aLee et al., 2012
BacteriaBacillus Cereus ATCC 14570American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaBacillus Polymyxa ATCC 842American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaBacillus SimplexReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBacillus Spp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaBacillus SubtilisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBacillus Subtilis GB03n/aLee et al., 2012
BacteriaBacillus WeihenstephanensisReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaBurkholderia Caribensis LMG 18531n/aBlom et al., 2011
BacteriaBurkholderia Glumae LMG 2196n/aBlom et al., 2011
BacteriaBurkholderia Lata LMG 6993n/aBlom et al., 2011
BacteriaBurkholderia Phenazinium LMG 2247n/aBlom et al., 2011
BacteriaBurkholderia Phenoliruptrix LMG 22037n/aBlom et al., 2011
BacteriaBurkholderia Pyrrocinia LMG 21822n/aBlom et al., 2011
BacteriaBurkholderia Sacchari LMG 19450n/aBlom et al., 2011
BacteriaBurkholderia Sp. AD24bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaBurkholderia Terricola LMG 20594n/aBlom et al., 2011
BacteriaBurkholderia Tropica MTo431n/aTenorio-Salgado et al., 2013
BacteriaBurkholderia Xenovorans LMG 21463n/aBlom et al., 2011
BacteriaChromobacterium Violaceum CV0n/aBlom et al., 2011
BacteriaChryseobacterium Sp. AD48nanaTyc et al., 2015
BacteriaCitrobacter Sp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaCupriavidus Necator LMG 1199n/aBlom et al., 2011
BacteriaCytophaga-Flavobacterium-Bacteroides Group Strain ARK 10141n/aDickschat et al., 2005_3
BacteriaCytophaga-Flavobacterium-Bacteroides Group Strain ARK 10146n/aDickschat et al., 2005_3
BacteriaDyella Sp. AD56nanaTyc et al., 2015
BacteriaEnterobacter Spp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaEnterococcus Durans ATCC 19432American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEnterococcus Faecium ATCC 19434American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaEscherichia Colin/aSiripatrawan et al., 2008
BacteriaEscherichia Coli ATCC15547American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaJanthinobacterium Sp. AD80nanaTyc et al., 2015
BacteriaKlebsiella OxytocaThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaKlebsiella Sp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLactobacillus BrevisThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLactobacillus HilgardiiThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLactobacillus Lactis ATCC 11955American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaLactobacillus PlantarumThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLactobacillus Sp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLactococcus Sp.This compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaLeuconostoc Mesenteroides ATCC 8086American Type Culture Collection (ATCC), Rockville, MD or wild strains identified at the University of Kentucky Dept. of Animal Sciences Food Microbiology LaboratoryElgaali et al. 2002
BacteriaLeuconostoc Mesenteroides Subsp. Mesenteroides CIRM1250can be used to modify or intensify the flavour of industrial cheeses or fermented milks or to preserve the peculiar flavour of traditional dairy productsPogačić et al., 2015
BacteriaLimnobacter Thiooxidans LMG 19593n/aBlom et al., 2011
BacteriaLysobacter Gummosusn/aZou et al., 2007
BacteriaMicrobacterium OxydansReduction of movement or death of Panagrelleus redivivus and Bursaphelenchus xylophilus.Gu et al., 2007
BacteriaOenococcus OeniThis compound is assumed to have an antagonistic effect against sapstain fungi.Schulz and Dickschat, 2007
BacteriaPaenibacillus Polymyxa E681n/aLee et al., 2012
BacteriaPaenibacillus Sp. AD87bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaPandoraea Norimbergensis LMG 18379n/aBlom et al., 2011
BacteriaProteus Hauseri JN092591Nematicidal activitycow dungXU et al., 2015
BacteriaPseudochrobactrum Saccharolyticum AM180484Nematicidal activitycow dungXU et al., 2015
BacteriaPseudomonas Aeruginosa PA01nanaBriard et al., 2016
BacteriaPseudomonas Aeruginosa PUPa3n/aBlom et al., 2011
BacteriaPseudomonas Chlororaphis 450bacteriostatic on Agrobacterium tumefaciens C58, suppresses growth of cyanobacterium strain Synechococcus sp. PCC 7942, kills Caenorhabditis elegansRhizosphere of maize, Kiev region, UkrainePopova et al., 2014
BacteriaPseudomonas Chlororaphis R47narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Fluorescens R76narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Fluorescens WCS 417rn/aBlom et al., 2011
BacteriaPseudomonas Frederiksbergensis S04naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S24naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Jessenii S34naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Perolens ATCC 10757nasterile fish muscle (Sebastes melanops)Miller et al., 1973
BacteriaPseudomonas Putida ISOfn/aBlom et al., 2011
BacteriaPseudomonas Putida USB2105reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Putida USB2106reduces mycelium growth and sclerotia germination of Sclerotinia sclerotiorum USB-F593; lyses red blood cellsrhizosphere of bean plants, southern ItalyGiorgio et al., 2015
BacteriaPseudomonas Syringae S22naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Tolaasii NCPPB 2192nanaCantore et al., 2015
BacteriaPseudomonas Tolaasii USB1nanaCantore et al., 2015
BacteriaPseudomonas Tolaasii USB66nanaCantore et al., 2015
Bacteria