Results for:
PubChem ID: 1030

Propane-1,2-diol

Mass-Spectra

Compound Details

Synonymous names
propylenglycol
alpha-Propyleneglycol
Methylethylene glycol
Isopropylene glycol
Monopropylene glycol
propylene glycol cefatrizine
Aliphatic alcohol
Centella Asiatica
DNIAPMSPPWPWGF-UHFFFAOYSA-N
Dowfrost
Methylethyl glycol
Prolugen
propylene glycol
propylene-glycol
Sirlene
Sirlenl
Trimethyl glycol
alpha-Propylene glycol
Sentry Propylene Glycol
2-Hydroxypropanol
All purpose lubricant
alpha-Propylene glycol;glycol
General lube
Propylene Glycol Reagent Grade
Propylene Glycol USP
Solargard P
a-Propylene glycol
Chilisa FE
dl-Propylene glycol
AC1L1AKN
Ilexan P
Propylene Glycol, Industrial Grade
Solar Winter BAN
ACMC-1AMKJ
Propylene Glycol, meets USP testing specifications
Propylene glycol, USP
1,2-dihydroxypropane
1,2-Dihydroxypropanl
1,2-propyleneglycol
1,2-Propylenglykol
HOCH2CH(OH)Me
MeCH(OH)CH2OH
.alpha.-Propylene glycol
E490
JEFFCOOL P150
KSC269I3T
methyl ethyl glycol (MEGl
Propylene Glycol (Fragrance Grade)
Propylene glycol, pharmaceutical secondary standard; traceable to USP
Ucar 35
1,2 Propanediol
1,2-propandiol
1,2-propanediol
1,2-Propanediol,cyclized
1.2-propanediol
1000PG
2,3-Propanediol
CH3CH(OH)CH2OH
HOCH2CH(OH)CH3
PG 12
CTK1G9439
E1520
HMDB01881
HSDB 174
Inhibited 1,2-propylene glycol
P0485
Propylene glycol (TN)
1,2-Propanediol, analytical reference material
1,2-Propylene glycol
ACMC-209jq5
ACMC-209jq6
CHEMBL286398
DB01839
NSC35747
NSC35748
NSC35749
NSC69860
Propylene glycol [USAN:JAN]
Propylene glycol, European Pharmacopoeia (EP) Reference Standard
RP18353
WLN: QY1&1Q
1,2-Propanediol, analytical standard
bmse000302
C00583
CCRIS 5929
D00078
DL-1,2-Propanediol
ETHYLDIOXY, 1-METHYL-
HMS3039O11
L-1,2-propanediol
1,2-propane diol
1,2-propane-diol
BBL011472
DTXSID0021206
LS-1391
OR033965
OR271045
OR315613
OR315615
Polypropylene glycol 1,000
Propan-1,2-Diol
propane-1,2-diol
PROPOXY, 2-HYDROXY-
Propylene glycol, United States Pharmacopeia (USP) Reference Standard
STL146584
Average MW 1000
CHEBI:16997
DSSTox_CID_1206
S(+)-Propylene glycol
AN-41725
ANW-49390
BP-21014
DSSTox_GSID_21206
DSSTox_GSID_27863
KB-64395
NSC 69860
NSC-35747
NSC-35748
NSC-35749
NSC-69860
Propylene Glycol 50/50
SC-16372
TRA0011379
TRA0062727
TRA0087797
1,2-Propanediol, ACS reagent
1,2-Propylenglykol [German]
BB_SC-7047
Caswell No. 713
DSSTox_RID_76010
DSSTox_RID_78594
MFCD00064272
Propylene glycol (JP17/USP)
SDM No. 27
AI3-01898
H[OCH(CH3)CH2]nOH
RTR-031941
Soybean oil, polymer with benzoic acid, pentaerythritol, phthalic anhydride and propylene glycol
TR-031941
AKOS000121049
AKOS016355793
EPA Pesticide Chemical Code 068603
Epitope ID:161748
Glycol, polypropylene (P400)
Glycol, polypropylene (P750)
I14-1669
I14-1679
I14-2780
J-502273
S-(+)-Propylene glycol
(+-)-Propylene glycol
BRN 1340498
FEMA No. 2940
FT-0605030
FT-0605236
FT-0606483
FT-0696553
MLS001055394
SMR000677948
(RS)-1,2-Propanediol
1,2-(RS)-Propanediol
57-55-6
Glycol, polypropylene (P1200)
ETHOXY, 2-HYDROXY-1-METHYL-
Tox21_111003
Tox21_201812
Tox21_300006
Tox21_301441
F1908-0071
Z1939437503
CAS-57-55-6
4254-16-4
MCULE-5574440784
NCGC00090739-01
NCGC00090739-02
NCGC00090739-03
NCGC00090739-04
NCGC00254159-01
NCGC00255183-01
NCGC00259361-01
EINECS 200-338-0
1,2-Propanediol, LR, >=99%
1,2-Propanediol, tested according to Ph.Eur.
63625-56-9
90529-63-8
1,2-Propanediol (8CI,9CI)
432-EP2269978A2
432-EP2269985A2
432-EP2269991A2
432-EP2269996A1
432-EP2270002A1
432-EP2270004A1
432-EP2270005A1
432-EP2270006A1
432-EP2270010A1
432-EP2270101A1
432-EP2270505A1
432-EP2272517A1
432-EP2272537A2
432-EP2272817A1
432-EP2272822A1
432-EP2272832A1
432-EP2272834A1
432-EP2272835A1
432-EP2272841A1
432-EP2272844A1
432-EP2272847A1
432-EP2272848A1
432-EP2272849A1
432-EP2274983A1
432-EP2275102A1
432-EP2275413A1
432-EP2275417A2
432-EP2275469A1
432-EP2277565A2
432-EP2277566A2
432-EP2277567A1
432-EP2277568A2
432-EP2277569A2
432-EP2277570A2
432-EP2277848A1
432-EP2277861A1
432-EP2277865A1
432-EP2277866A1
432-EP2277876A1
432-EP2277877A1
432-EP2277879A1
432-EP2277881A1
432-EP2280001A1
432-EP2280008A2
432-EP2280010A2
432-EP2281816A1
432-EP2281818A1
432-EP2281819A1
432-EP2281823A2
432-EP2283811A1
432-EP2284149A1
432-EP2284150A2
432-EP2284151A2
432-EP2284152A2
432-EP2284153A2
432-EP2284155A2
432-EP2284156A2
432-EP2284157A1
432-EP2284159A1
432-EP2284160A1
432-EP2284162A2
432-EP2284163A2
432-EP2284164A2
432-EP2284165A1
432-EP2284169A1
432-EP2284170A1
432-EP2284172A1
432-EP2284178A2
432-EP2284179A2
432-EP2286812A1
432-EP2287140A2
432-EP2287147A2
432-EP2287148A2
432-EP2287150A2
432-EP2287156A1
432-EP2287160A1
432-EP2287161A1
432-EP2287162A1
432-EP2287163A1
432-EP2287165A2
432-EP2287166A2
432-EP2287167A1
432-EP2287940A1
432-EP2289868A1
432-EP2289871A1
432-EP2289879A1
432-EP2289883A1
432-EP2289890A1
432-EP2289892A1
432-EP2289965A1
432-EP2292227A2
432-EP2292228A1
432-EP2292233A2
432-EP2292280A1
432-EP2292590A2
432-EP2292592A1
432-EP2292593A2
432-EP2292597A1
432-EP2292611A1
432-EP2292612A2
432-EP2292614A1
432-EP2292619A1
432-EP2292620A2
432-EP2292622A1
432-EP2295055A2
432-EP2295399A2
432-EP2295402A2
432-EP2295406A1
432-EP2295408A1
432-EP2295409A1
432-EP2295410A1
432-EP2295411A1
432-EP2295412A1
432-EP2295413A1
432-EP2295415A1
432-EP2295416A2
432-EP2295419A2
432-EP2295426A1
432-EP2295427A1
432-EP2295429A1
432-EP2295430A2
432-EP2295431A2
432-EP2295434A2
432-EP2295437A1
432-EP2295438A1
432-EP2295550A2
432-EP2298731A1
432-EP2298732A1
432-EP2298734A2
432-EP2298735A1
432-EP2298742A1
432-EP2298747A1
432-EP2298748A2
432-EP2298764A1
432-EP2298765A1
432-EP2298766A1
432-EP2298770A1
432-EP2298772A1
432-EP2298775A1
432-EP2298783A1
432-EP2298828A1
432-EP2301534A1
432-EP2301536A1
432-EP2301538A1
432-EP2301912A2
432-EP2301913A1
432-EP2301914A1
432-EP2301916A2
432-EP2301919A1
432-EP2301922A1
432-EP2301924A1
432-EP2301929A1
432-EP2301935A1
432-EP2301936A1
432-EP2301937A1
432-EP2301939A1
432-EP2301983A1
432-EP2305243A1
432-EP2305625A1
432-EP2305636A1
432-EP2305637A2
432-EP2305641A1
432-EP2305642A2
432-EP2305648A1
432-EP2305651A1
432-EP2305658A1
432-EP2305659A1
432-EP2305668A1
432-EP2305671A1
432-EP2305674A1
432-EP2305677A1
432-EP2305678A1
432-EP2305679A1
432-EP2305682A1
432-EP2305683A1
432-EP2305688A1
432-EP2305695A2
432-EP2305696A2
432-EP2305697A2
432-EP2305698A2
432-EP2308479A2
432-EP2308492A1
432-EP2308510A1
432-EP2308562A2
432-EP2308812A2
432-EP2308828A2
432-EP2308832A1
432-EP2308838A1
432-EP2308839A1
432-EP2308840A1
432-EP2308844A2
432-EP2308845A2
432-EP2308846A2
432-EP2308854A1
432-EP2308857A1
432-EP2308858A1
432-EP2308861A1
432-EP2308863A1
432-EP2308865A1
432-EP2308867A2
432-EP2308869A1
432-EP2308870A2
432-EP2308872A1
432-EP2308873A1
432-EP2308874A1
432-EP2308875A1
432-EP2308879A1
432-EP2308926A1
432-EP2309564A1
432-EP2311451A1
432-EP2311453A1
432-EP2311455A1
432-EP2311464A1
432-EP2311494A1
432-EP2311796A1
432-EP2311797A1
432-EP2311798A1
432-EP2311799A1
432-EP2311806A2
432-EP2311807A1
432-EP2311809A1
432-EP2311815A1
432-EP2311816A1
432-EP2311817A1
432-EP2311818A1
432-EP2311821A1
432-EP2311823A1
432-EP2311824A1
432-EP2311829A1
432-EP2311831A1
432-EP2311832A1
432-EP2311833A1
432-EP2311835A1
432-EP2311836A1
432-EP2311837A1
432-EP2311839A1
432-EP2311840A1
432-EP2311842A2
432-EP2314571A2
432-EP2314575A1
432-EP2314577A1
432-EP2314582A1
432-EP2314584A1
432-EP2314586A1
432-EP2314588A1
432-EP2314589A1
432-EP2314590A1
432-EP2315303A1
432-EP2316450A1
432-EP2316452A1
432-EP2316470A2
432-EP2316829A1
432-EP2316831A1
432-EP2316832A1
432-EP2316833A1
432-EP2316834A1
432-EP2316835A1
432-EP2316836A1
432-EP2316837A1
432-EP2371797A1
432-EP2371800A1
432-EP2371809A1
432-EP2371811A2
432-EP2372017A1
432-EP2374454A1
432-EP2374783A1
432-EP2374790A1
432-EP2374792A1
432-EP2374895A1
432-EP2377841A1
432-EP2377849A2
432-EP2380568A1
432-EP2380873A1
123120-98-9
190913-75-8
(+-)-1,2-Propanediol
1,2-Propanediol, ReagentPlus(R), >=99%
CAS-25322-69-4
MolPort-001-768-866
Propylene glycol, >=99.5%, FCC, FG
1,2-Propanediol, ReagentPlus(R), 99%
15490-EP2295399A2
15490-EP2305669A1
15490-EP2305683A1
15490-EP2311839A1
15490-EP2314589A1
15490-EP2316837A1
55805-EP2287158A1
55805-EP2298415A1
55805-EP2305033A1
55805-EP2308864A1
69996-EP2308479A2
98469-EP2275417A2
98469-EP2284162A2
98469-EP2284163A2
98469-EP2284174A1
98469-EP2301919A1
98469-EP2374783A1
98469-EP2377841A1
98469-EP2380568A1
1,2-Propanediol, ACS reagent, >=99.5%
1,2-Propanediol, USP, 99.5%
135584-EP2287158A1
135584-EP2292608A1
1,2-Propanediol, 98% 500g
1,2-Propanediol, SAJ special grade, >=99.0%
58858-91-6 (hydrochloride salt)
1,2-Propanediol, puriss., 99.5%
1,2-Propanediol, SAJ first grade, >=99.0%
1,2-Propanediol, Vetec(TM) reagent grade, 98%
(.+/-.)-1,2-Propanediol
3-01-00-02142 (Beilstein Handbook Reference)
1,2-Propanediol, p.a., ACS reagent, 99.5%
Poly[oxy(methyl-1,2-ethanediyl)], .alpha.-hydro-.omega.-hydroxy-
1,2-Propanediol, meets analytical specification of Ph. Eur., BP, USP, >=99.5%
1,2-Propanediol, puriss. p.a., ACS reagent, >=99.5% (GC)
Microorganism:

Yes

IUPAC namepropane-1,2-diol
SMILESCC(CO)O
InchiInChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3
FormulaCH3CHOHCH2OH
PubChem ID1030
Molweight76.095
LogP-0.79
Atoms13
Bonds12
H-bond Acceptor2
H-bond Donor2
Chemical Classificationalcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for propylene glycol is estimated as 1.3X10-8 atm-cu m/mole(SRC) derived from its vapor pressure, 0.13 mm Hg(1), and assigned value for water solubility of 1X10+6 mg/L (miscible)(2). This Henry's Law constant indicates that propylene glycol is expected to be essentially nonvolatile from water surfaces(3). Propylene glycol 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 Washington, DC: Taylor and Francis (1989) (2) Yalkowsky SH, He Y; Handbook of Aqueous Solubility Data: An Extensive Compilation of Aqueous Solubility Data for Organic Compounds Extracted from the AQUASOL dATAbASE. Boca Raton, FL: CRC Press LLC, (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 of propylene glycol is estimated as 1(SRC), using a log Kow of -0.92(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that propylene glycol is expected to have very 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. 7 (1995) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.0. Jan, 2009. Available from http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm as of Feb 12, 2010. (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
0.13 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
BacteriaStaphylococcus Epidermidis ATCC 12228Lemfack et al. 2016
BacteriaStaphylococcus Epidermidis DSM 3269clinical isolate,catheterLemfack et al. 2016
BacteriaStaphylococcus Saccharolyticus B5709clinical isolateLemfack et al. 2016
FungiTuber Mesentericumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaStaphylococcus Epidermidis ATCC 12228brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Epidermidis DSM 3269brain heart infusion mediumPorapak / GC/MSno
BacteriaStaphylococcus Saccharolyticus B5709brain heart infusion mediumPorapak / GC/MSno
FungiTuber Mesentericumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)