methylbenzene

methylbenzol

Phenylmethane

Benzylidyne radical

paratoluene

methacide

monomethyl benzene

YXFVVABEGXRONW-UHFFFAOYSA-N

Anisen

Cresyl

Dracyl

Otoline

Tolueen

Toluen

toluene

Toluene, Spectrophotometric Grade

Tolueno

toluol

Toluolo

methyl-Benzene

phenyl methane

para-toluene

1-Methylbenzene

2-methylbenzene

4-methylbenzene

p-toluene

Toluene HPLC grade

Toluene, analytical standard

Toluene, anhydrous

Toluene, Environmental Grade

Toluene, Semiconductor Grade

AC1L1ATE

tolu-sol

Toluene ACS Grade

Toluene Reagent Grade ACS

toluene-

antisal 1a

Benzene, methyl

4i7k

Toluene disproportionation catalyst ZA-90

2-methyl benzene

AC1L4W1C

ACMC-20egwh

Toluene (Technical)

Toluene, ACS reagent

Toluene, HPLC Grade

Toluene, suitable for determination of dioxins

CHEMBL9113

Residual Solvent - Toluene

Toluene, for HPLC

Tolueno [Spanish]

Toluolo [Italian]

Benzene, methyl-

GTPL5481

Methane, phenyl-

PHENYL, METHYL-

Tolueen [Dutch]

TOLUENE- D8

Toluene, pharmaceutical secondary standard; traceable to USP

CP 25

LS-26

Toluen [Czech]

Toluene GC, for residue analysis

UN1294

3FPU23BG52

HSDB 131

S0638

WLN: 1R

BIDD:ER0288

RL00380

C01455

CCRIS 2366

LTBB002867

OTOLINE (9CI)

RCRA waste number U220

UNII-3FPU23BG52

ZINC967534

NSC406333

OR034283

OR079732

OR199992

OR242367

OR252118

OR256430

OR274999

OR328992

UN 1294

ZB015462

300204X

A801937

CHEBI:17578

DSSTox_CID_1360

NCI-C07272

AN-42912

ANW-44012

DSSTox_GSID_21360

KB-54750

SC-19104

BDBM50008558

Caswell No. 859

DSSTox_RID_76107

MFCD00008512

Toluene, 99.5%

Toluene, LR, >=99%

AI3-02261

NSC 406333

NSC-406333

RTR-002003

TR-002003

AKOS015840411

EPA Pesticide Chemical Code 080601

I01-4407

RCRA waste no. U220

Toluene, ACS spectrophotometric grade, >=99.5%

ZINC100116646

FT-0626841

FT-0654077

FT-0659221

Toluene, Laboratory Reagent, >=99.3%

Toluene, suitable for scintillation, >=99.7%

Poly(1,4-phenylenemethylene)(9CI)

Toluene, 99% 1L

Toluene, anhydrous, 99.8%

Toluene, purification grade, 99.8%

Toluene, LR, rectified, 99%

Toluene, technical grade, 95.0%

Tox21_111042

Tox21_201224

108-88-3

Toluene, ACS reagent, >=99.5%

Toluene, AR, >=99.5%

Toluene, ASTM, 99.5%

Toluene, PRA grade, >=99.8%

Toluene, UV HPLC spectroscopic, 99.5%

MCULE-4817136027

NCGC00090939-01

NCGC00090939-02

NCGC00090939-03

NCGC00258776-01

Toluene, for HPLC, >=99.8%

Toluene, for HPLC, >=99.9%

Toluene, HPLC grade, 99.8%

Toluene, JIS special grade, >=99.5%

Toluene, LR, sulfur free, 99%

CAS-108-88-3

EINECS 203-625-9

Toluene, for HPLC, 99.9%

Toluene, SAJ first grade, >=99.0%

50643-04-4

Toluene [UN1294] [Flammable liquid]

941-EP0930075A1

941-EP2269975A2

941-EP2269977A2

941-EP2269978A2

941-EP2269979A1

941-EP2269985A2

941-EP2269986A1

941-EP2269987A1

941-EP2269988A2

941-EP2269989A1

941-EP2269990A1

941-EP2269991A2

941-EP2269992A1

941-EP2269993A1

941-EP2269995A1

941-EP2269997A2

941-EP2270000A1

941-EP2270001A1

941-EP2270002A1

941-EP2270003A1

941-EP2270004A1

941-EP2270006A1

941-EP2270008A1

941-EP2270009A1

941-EP2270010A1

941-EP2270011A1

941-EP2270014A1

941-EP2270101A1

941-EP2270113A1

941-EP2270114A1

941-EP2270505A1

941-EP2272509A1

941-EP2272516A2

941-EP2272517A1

941-EP2272537A2

941-EP2272813A2

941-EP2272817A1

941-EP2272822A1

941-EP2272825A2

941-EP2272827A1

941-EP2272828A1

941-EP2272829A2

941-EP2272830A1

941-EP2272831A1

941-EP2272832A1

941-EP2272834A1

941-EP2272835A1

941-EP2272837A1

941-EP2272838A1

941-EP2272839A1

941-EP2272840A1

941-EP2272841A1

941-EP2272842A1

941-EP2272843A1

941-EP2272844A1

941-EP2272847A1

941-EP2272848A1

941-EP2272849A1

941-EP2272935A1

941-EP2274983A1

941-EP2275102A1

941-EP2275395A2

941-EP2275401A1

941-EP2275403A1

941-EP2275404A1

941-EP2275407A1

941-EP2275409A1

941-EP2275410A1

941-EP2275411A2

941-EP2275413A1

941-EP2275414A1

941-EP2275415A2

941-EP2275416A1

941-EP2275418A1

941-EP2275427A1

941-EP2275469A1

941-EP2277848A1

941-EP2277858A1

941-EP2277861A1

941-EP2277865A1

941-EP2277867A2

941-EP2277871A1

941-EP2277875A2

941-EP2277877A1

941-EP2277878A1

941-EP2277880A1

941-EP2277881A1

941-EP2279750A1

941-EP2280000A1

941-EP2280001A1

941-EP2280003A2

941-EP2280004A1

941-EP2280005A1

941-EP2280006A1

941-EP2280007A1

941-EP2280008A2

941-EP2280009A1

941-EP2280010A2

941-EP2280011A1

941-EP2280012A2

941-EP2280014A2

941-EP2280020A1

941-EP2280021A1

941-EP2281563A1

941-EP2281810A1

941-EP2281812A1

941-EP2281813A1

941-EP2281815A1

941-EP2281817A1

941-EP2281818A1

941-EP2281819A1

941-EP2281820A2

941-EP2281821A1

941-EP2281822A1

941-EP2281899A2

941-EP2284148A1

941-EP2284149A1

941-EP2284150A2

941-EP2284151A2

941-EP2284152A2

941-EP2284153A2

941-EP2284155A2

941-EP2284156A2

941-EP2284157A1

941-EP2284158A1

941-EP2284159A1

941-EP2284160A1

941-EP2284164A2

941-EP2284165A1

941-EP2284167A2

941-EP2284168A2

941-EP2284169A1

941-EP2284170A1

941-EP2284172A1

941-EP2284174A1

941-EP2284920A1

941-EP2286811A1

941-EP2286915A2

941-EP2287140A2

941-EP2287141A1

941-EP2287147A2

941-EP2287148A2

941-EP2287150A2

941-EP2287152A2

941-EP2287153A1

941-EP2287154A1

941-EP2287155A1

941-EP2287156A1

941-EP2287157A1

941-EP2287159A1

941-EP2287161A1

941-EP2287162A1

941-EP2287165A2

941-EP2287166A2

941-EP2287167A1

941-EP2287168A2

941-EP2287940A1

941-EP2289509A2

941-EP2289510A1

941-EP2289868A1

941-EP2289876A1

941-EP2289877A1

941-EP2289879A1

941-EP2289883A1

941-EP2289884A1

941-EP2289885A1

941-EP2289887A2

941-EP2289888A2

941-EP2289890A1

941-EP2289892A1

941-EP2289893A1

941-EP2289894A2

941-EP2289896A1

941-EP2289897A1

941-EP2289965A1

941-EP2292227A2

941-EP2292228A1

941-EP2292233A2

941-EP2292586A2

941-EP2292589A1

941-EP2292592A1

941-EP2292593A2

941-EP2292595A1

941-EP2292596A2

941-EP2292597A1

941-EP2292599A1

941-EP2292601A1

941-EP2292602A1

941-EP2292603A1

941-EP2292604A2

941-EP2292606A1

941-EP2292607A2

941-EP2292609A1

941-EP2292610A1

941-EP2292612A2

941-EP2292615A1

941-EP2292617A1

941-EP2292618A1

941-EP2292619A1

941-EP2292620A2

941-EP2292621A1

941-EP2292622A1

941-EP2292624A1

941-EP2292628A2

941-EP2292629A1

941-EP2293650A1

941-EP2295053A1

941-EP2295399A2

941-EP2295401A2

941-EP2295406A1

941-EP2295407A1

941-EP2295409A1

941-EP2295410A1

941-EP2295411A1

941-EP2295412A1

941-EP2295413A1

941-EP2295414A1

941-EP2295415A1

941-EP2295416A2

941-EP2295417A1

941-EP2295418A1

941-EP2295419A2

941-EP2295420A1

941-EP2295421A1

941-EP2295423A1

941-EP2295425A1

941-EP2295426A1

941-EP2295427A1

941-EP2295429A1

941-EP2295432A1

941-EP2295433A2

941-EP2295437A1

941-EP2295438A1

941-EP2295439A1

941-EP2295503A1

941-EP2298312A1

941-EP2298313A1

941-EP2298729A1

941-EP2298731A1

941-EP2298734A2

941-EP2298735A1

941-EP2298736A1

941-EP2298737A1

941-EP2298739A1

941-EP2298740A1

941-EP2298741A1

941-EP2298742A1

941-EP2298743A1

941-EP2298744A2

941-EP2298745A1

941-EP2298746A1

941-EP2298747A1

941-EP2298748A2

941-EP2298749A1

941-EP2298750A1

941-EP2298751A2

941-EP2298752A1

941-EP2298753A1

941-EP2298754A1

941-EP2298755A1

941-EP2298756A1

941-EP2298757A2

941-EP2298758A1

941-EP2298759A1

941-EP2298761A1

941-EP2298763A1

941-EP2298764A1

941-EP2298765A1

941-EP2298767A1

941-EP2298768A1

941-EP2298770A1

941-EP2298771A2

941-EP2298772A1

941-EP2298774A1

941-EP2298775A1

941-EP2298776A1

941-EP2298777A2

941-EP2298778A1

941-EP2298779A1

941-EP2298780A1

941-EP2298783A1

941-EP2298828A1

941-EP2299326A1

941-EP2299509A1

941-EP2299510A1

941-EP2299785A1

941-EP2301536A1

941-EP2301538A1

941-EP2301627A1

941-EP2301911A1

941-EP2301918A1

941-EP2301919A1

941-EP2301920A1

941-EP2301921A1

941-EP2301922A1

941-EP2301923A1

941-EP2301924A1

941-EP2301925A1

941-EP2301926A1

941-EP2301927A1

941-EP2301928A1

941-EP2301929A1

941-EP2301930A1

941-EP2301931A1

941-EP2301932A1

941-EP2301933A1

941-EP2301934A1

941-EP2301935A1

941-EP2301936A1

941-EP2301937A1

941-EP2301939A1

941-EP2301940A1

941-EP2301983A1

941-EP2302003A1

941-EP2302015A1

941-EP2305219A1

941-EP2305250A1

941-EP2305254A1

941-EP2305257A1

941-EP2305625A1

941-EP2305627A1

941-EP2305633A1

941-EP2305636A1

941-EP2305637A2

941-EP2305640A2

941-EP2305641A1

941-EP2305642A2

941-EP2305643A1

941-EP2305646A1

941-EP2305647A1

941-EP2305648A1

941-EP2305649A1

941-EP2305650A1

941-EP2305651A1

941-EP2305652A2

941-EP2305655A2

941-EP2305656A1

941-EP2305658A1

941-EP2305659A1

941-EP2305660A1

941-EP2305662A1

941-EP2305664A1

941-EP2305666A1

941-EP2305667A2

941-EP2305668A1

941-EP2305669A1

941-EP2305671A1

941-EP2305672A1

941-EP2305674A1

941-EP2305675A1

941-EP2305676A1

941-EP2305677A1

941-EP2305679A1

941-EP2305680A2

941-EP2305682A1

941-EP2305684A1

941-EP2305685A1

941-EP2305686A1

941-EP2305687A1

941-EP2305688A1

941-EP2305695A2

941-EP2305696A2

941-EP2305697A2

941-EP2305698A2

941-EP2305769A2

941-EP2305808A1

941-EP2305825A1

941-EP2306788A1

941-EP2306789A1

941-EP2308471A1

941-EP2308479A2

941-EP2308492A1

941-EP2308510A1

941-EP2308562A2

941-EP2308812A2

941-EP2308828A2

941-EP2308831A1

941-EP2308833A2

941-EP2308838A1

941-EP2308839A1

941-EP2308840A1

941-EP2308841A2

941-EP2308843A1

941-EP2308844A2

941-EP2308845A2

941-EP2308846A2

941-EP2308848A1

941-EP2308849A1

941-EP2308850A1

941-EP2308851A1

941-EP2308853A1

941-EP2308854A1

941-EP2308857A1

941-EP2308858A1

941-EP2308861A1

941-EP2308862A1

941-EP2308864A1

941-EP2308865A1

941-EP2308867A2

941-EP2308868A1

941-EP2308869A1

941-EP2308870A2

941-EP2308871A1

941-EP2308872A1

941-EP2308873A1

941-EP2308874A1

941-EP2308875A1

941-EP2308876A1

941-EP2308877A1

941-EP2308879A1

941-EP2308880A1

941-EP2308882A1

941-EP2308926A1

941-EP2308960A1

941-EP2309564A1

941-EP2309584A1

941-EP2311455A1

941-EP2311464A1

941-EP2311801A1

941-EP2311802A1

941-EP2311803A1

941-EP2311804A2

941-EP2311805A1

941-EP2311806A2

941-EP2311807A1

941-EP2311808A1

941-EP2311811A1

941-EP2311813A1

941-EP2311814A1

941-EP2311815A1

941-EP2311816A1

941-EP2311817A1

941-EP2311818A1

941-EP2311820A1

941-EP2311822A1

941-EP2311823A1

941-EP2311824A1

941-EP2311826A2

941-EP2311827A1

941-EP2311829A1

941-EP2311830A1

941-EP2311831A1

941-EP2311835A1

941-EP2311836A1

941-EP2314295A1

941-EP2314558A1

941-EP2314571A2

941-EP2314574A1

941-EP2314575A1

941-EP2314576A1

941-EP2314577A1

941-EP2314578A1

941-EP2314579A1

941-EP2314581A1

941-EP2314582A1

941-EP2314583A1

941-EP2314585A1

941-EP2314586A1

941-EP2314587A1

941-EP2314588A1

941-EP2314590A1

941-EP2314591A1

941-EP2314593A1

941-EP2315303A1

941-EP2315502A1

941-EP2316452A1

941-EP2316457A1

941-EP2316824A1

941-EP2316825A1

941-EP2316826A1

941-EP2316827A1

941-EP2316829A1

941-EP2316831A1

941-EP2316832A1

941-EP2316833A1

941-EP2316835A1

941-EP2316836A1

941-EP2370383A2

941-EP2371795A1

941-EP2371797A1

941-EP2371798A1

941-EP2371800A1

941-EP2371804A1

941-EP2371805A1

941-EP2371810A1

941-EP2371811A2

941-EP2371812A1

941-EP2371813A1

941-EP2371814A1

941-EP2371831A1

941-EP2372804A1

941-EP2374454A1

941-EP2374783A1

941-EP2374787A1

941-EP2374788A1

941-EP2374790A1

941-EP2374895A1

941-EP2377841A1

941-EP2377845A1

941-EP2377847A1

941-EP2378585A1

941-EP2380568A1

941-EP2380867A1

941-EP2380873A1

941-EP2380874A2

EC 203-625-9

SR-01000944565

Toluene, AR, rectified, 99.5%

4489-EP2272846A1

Toluene, suitable for 5000 per JIS, for residue analysis

1053657-77-4

1202864-97-8

Toluene [UN1294] [Flammable liquid]

28403-EP2269977A2

28403-EP2311830A1

28403-EP2314581A1

28443-EP2269995A1

28443-EP2275403A1

28443-EP2284178A2

28443-EP2284179A2

28443-EP2292615A1

28443-EP2298738A1

28443-EP2298776A1

28443-EP2301627A1

28443-EP2301937A1

28443-EP2305685A1

28443-EP2305686A1

28443-EP2311464A1

28443-EP2314581A1

28443-EP2371805A1

28443-EP2377847A1

48782-EP2272834A1

48782-EP2275398A1

48782-EP2284165A1

48782-EP2298745A1

48782-EP2301929A1

48782-EP2301935A1

48782-EP2305674A1

48782-EP2311812A1

56745-EP2272846A1

56745-EP2275408A1

56745-EP2275422A1

56745-EP2277862A2

56745-EP2277868A1

56745-EP2277869A1

56745-EP2277870A1

56745-EP2281861A2

56745-EP2284166A1

56745-EP2287164A1

56745-EP2289483A1

56745-EP2289881A1

56745-EP2292608A1

56745-EP2292616A1

56745-EP2292625A1

56745-EP2295422A2

56745-EP2295436A1

56745-EP2298076A1

56745-EP2298077A1

56745-EP2298305A1

56745-EP2298749A1

56745-EP2298762A2

56745-EP2298769A1

56745-EP2298773A1

56745-EP2301353A1

56745-EP2305031A1

56745-EP2305033A1

56745-EP2305034A1

56745-EP2305035A1

56745-EP2308866A1

56745-EP2308878A2

56745-EP2371806A1

56745-EP2371807A1

56745-EP2371823A1

56745-EP2374791A1

56745-EP2380874A2

Toluene, p.a., 99.5%

133890-EP2275410A1

133890-EP2295420A1

SR-01000944565-1

Toluene liquid density, NIST(R) SRM(R) 211d

Toluene, for residue analysis, >=99.8% (GC)

Toluene, anhydrous, ZerO2(TM), 99.8%

Toluene, for HPLC, >=99.7% (GC)

Toluene, puriss., >=99.5% (GC)

TOLUENE (TECHNICAL) (SEE ALSOTOLUENE (NITRATION GRADE) NTP10009-V)

TOLUENE (SEE ALSO TOLUENE (TECHNICAL), NTP 11617-L)

Toluene, suitable for 300 per JIS, for residue analysis, >=99.8%

Toluene, HPLC Plus, for HPLC, GC, and residue analysis, >=99.9%

Toluene, suitable for 1000 per JIS, for residue analysis, >=99.8%

Toluene, p.a., ACS reagent, reag. ISO, 99.5%

Toluene, absolute, over molecular sieve (H2O <=0.005%), >=99.7% (GC)

InChI=1/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H

Toluene, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.5%

Toluene, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99.7% (GC)

The Henry's Law constant for toluene is 6.64X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that toluene 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 2.9 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)(2) is estimated as 3.8 days(SRC). Toluene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Toluene is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 28.4 mm Hg(3). The air-water interface equilibrium partitioning coefficient for toluene, at a concentration of 0.47 mg/L, has been reported to be 0.223, 0.226, 0.273, and 0.336 at 26.9, 31.9, 36.9, and 41.9 deg C, respectively(4). A first-order volatilization rate calculated for toluene from water using an inverse reactive simulation was reported as 6.62X10-6/sec(5). The volatilization half-life of toluene from a water column of one meter depth was estimated to be 5.18 hours(6). Toluene was reported to have a disappearance half-life of <2 days due to volatilization in two different soil types, a Captina silt loam and a McLaurin sandy loam(7).
Literature: (1) Mackay D et al; Environ Sci Technol 13: 333-6 (1979) (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) (4) Cheng W-H et al; Atmos Environ 37: 4807-4815 (2003) (5) Keefe SH et al; Environ Sci Technol 38: 2209-2216 (2004) (6) Mackay D, Leinonen PJ; Environ Sci Technol 9: 1178-80 (1975) (7) Anderson TA et al; J Environ Qual 20:420-4 (1991)

The Koc of toluene was reported as 178 in a sandy soil(1) and as 37 (Wendover silty loam), 160 (Grimsby silt loam), 160 (Vaudreil sandy loam) and 46 (sandy soil)(2). The Koc of toluene in lake sediment was measured as 166(3). According to a classification scheme(4), these measured Koc values suggest that toluene is expected to have high to moderate mobility in soil.
Literature: (1) Wilson JT et al; J Environ Qual 10: 501-6 (1981) (2) Nathwani JS, Phillips CR; Chemosphere 6: 157-62 (1977) (3) Kan AT et al; Environ Sci Technol 32: 892-902 (1998) (4) Swann RL et al; Res Rev 85: 17-28 (1983)
Literature: #In association with clay minerals, toluene's adsorption is inversely proportional to the pH of the soil. Approximately 40-70% of toluene applied to the surface of sandy soils is volatilized.
Literature: IARC. Monographs on the Evaluation of the Carcinogenic Risk of Chemicals to Humans. Geneva: World Health Organization, International Agency for Research on Cancer, 1972-PRESENT. (Multivolume work). Available at: http://monographs.iarc.fr/ENG/Classification/index.php, p. V47: 90 (1989)

Neomenthol

Racementhol

Fisherman's friend lozenges

Mentholum

NOOLISFMXDJSKH-UHFFFAOYSA-N

MENTHOL

Menthyl alcohol

Robitussin Cough Drops

Therapeutic mineral ice

d-Neomenthol

Mineral ice

dl-Menthol

AC1Q2QQM

2-Isopropyl-5-methylcyclohexanol

DL-Menthol, analytical standard

AC1L1B2E

ACMC-1BQW4

L7T10EIP3A

SCHEMBL4612

2-Isopropyl-5-methylcyclohexanol #

3-p-Menthol

K601

2-Isopropyl-5-methyl-cyclohexanol

Fisherman's friend lozenges (TN)

Menthol (USP)

Menthol [USP]

UNII-L7T10EIP3A

(?)-Menthol

dl-3-p-Menthanol

H2461

M0321

Menthol, 99%

AM81446

CHEMBL256087

LS-886

Menthol(-)

p-Menthan-3-ol

RL02685

RP22054

1-methyl-4-isopropyl-3-hydroxycyclohexane

19863P

CCRIS 9231

D04849

D04918

DSSTox_CID_805

AK111256

BBL009325

BT000185

DL-MENTHOL, CRYSTAL, USP

DR000160

DTXSID8029650

OR223322

OR240888

OR273366

STK802468

A808833

CHEBI:25187

L(-)-Menthol

RACEMIC MENTHOL U.S.P.

(-) menthol

(+) Menthol

(+)-Menthol

2-Isopropyl-5-methylcyclohexan-1-ol

4-Isopropyl-1-methylcyclohexan-3-ol

AN-19301

AN-19302

AN-19706

AN-20764

AN-24175

ANW-21459

D-p-Menthan-3-ol

DSSTox_GSID_29650

KB-78308

LS-57201

LS-89531

SC-01321

SC-54016

SC-84251

Caswell No. 540

DSSTox_RID_78794

MFCD00001484

(+)-Neo-menthol

AI3-08161

DB-063989

dl-Menthol (JP17)

KB-231063

ST24028056

TC-030785

TC-110204

5-Methyl-2-(1-methylethyl)cyclohexanol

AKOS000119740

AKOS016843634

EPA Pesticide Chemical Code 051601

I14-7371

J-500418

FT-0620596

FT-0625488

FT-0693479

FT-0695077

FT-0695078

FT-0695079

89-78-1

Tox21_200010

Tox21_303464

491-01-0

5-Methyl-2-(1-methylethyl)-cyclohexanol

Z1258992394

(+/-) menthol

(+/-)-Menthol

5-methyl-2-(propan-2-yl)cyclohexanol

1490-04-6

MCULE-3070949324

Menthol, SAJ special grade, >=98.0%

NCGC00159382-03

NCGC00159382-04

NCGC00159382-05

NCGC00159382-06

NCGC00257403-01

NCGC00257564-01

5-methyl-2-propan-2-yl-1-cyclohexanol

5-methyl-2-propan-2-ylcyclohexan-1-ol

EINECS 216-074-4

MENTHOL, (+)-neo-

Menthol, puriss., 99.0%

15356-70-4

20747-49-3

Cyclohexanol 5-methyl-2-(1-methylethyl)-

DL-Menthol, >=95%, FCC, FG

(+)-p-Menthan-3-ol

CAS-1490-04-6

EC 216-074-4

(DL)-5-methyl-2-(1-methylethyl)cyclohexanol

5-methyl-2-propan-2-yl-cyclohexan-1-ol

MolPort-000-849-729

Cyclohexanol, 5-methyl-2-(1-methylethyl)-

(1S,2R,5R)-2-isopropyl-5-methyl-cyclohexanol

5-methyl-2-(propan-2-yl)cyclohexan-1-ol

Menthol, trans-1,3,trans-1,4-

(+/-)-p-Menthan-3-ol

(1S,2R,5R)-(+)-Isomenthol

Menthol, (.+/-.)-

5-methyl-2-(1-methylethyl)cyclohexanol (1alpha, 2beta, 5alpha)

(1S, 2S, 5R)-(+)-Neomenthol

cis-1,3-trans-1,4-(+-)-menthol

cis-1 ,3-trans-1,4-(+-)-menthol

(+/-)-Menthol, racemic, >=98.0% (GC)

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5S)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1S,2R,5R)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1S,2S,5R)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2R,5S)-rel-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-rel-

Cyclohexanol, 5-methyl-2-propyl-, (1S-(1-alpha,2-alpha,5-beta))-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1?,2?,5ss)]-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1?,2ss,5?)]-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1alpha,2beta,5alpha)-(+-)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1.alpha.,2.alpha.,5.beta.)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1.alpha.,2.beta.,5.alpha.)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1?,2ss,5?)-(+/-)-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1R-(1.alpha.,2.alpha.,5.beta.)]-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1.alpha.,2.alpha.,5.beta.)]-

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, [1S-(1.alpha.,2.beta.,5.beta.)]-

Menthol solution, NMR reference standard, 30 wt. % in chloroform-d (99.8 atom % D), NMR tube size 5 mm x 8 in.

Cyclohexanol, 5-methyl-2-(1-methylethyl)-, (1.alpha.,2.beta.,5.alpha.)-(.+/-.)-

Menthol solution, NMR reference standard, 50% in chloroform-d (99.8 atom % D), chromium(III) acetylacetonate 0.5 %, NMR tube size 5 mm x 8 in.

The Henry's Law constant for menthol is estimated as 2.6X10-5 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that menthol 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 18 days(SRC). Menthol's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Menthol is not expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 7.7X10-3 mm Hg(SRC), determined from a fragment constant method(1).
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of May 13, 2015: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)

Using a structure estimation method based on molecular connectivity indices(1), the Koc of menthol can be estimated to be 88(SRC). According to a classification scheme(2), this estimated Koc value suggests that menthol is expected to have high mobility in soil.
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of May 13, 2015: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm

hexadecylalcohol

Isohexadecanol

cetylalcohol

Cetylalkohol

HEXADECANOL

Isohexadecyl alcohol

BXWNKGSJHAJOGX-UHFFFAOYSA-N

Cetaffine

Hexadecyl alcohol

Cetanol

Cetylic alcohol

Cetylol

Hyfatol

Isocetyl alcohol

palmitic alcohol

Palmityl alcohol

1-Hydroxyhexadecane

Cetal

cetyl alcohol

Ethal

Ethol

Hexadecanol NF

Loxanwachs SK

N-Hexadecanol

Normal primary hexadecyl alcohol

Ceraphyl ICA

Crodacol-CAS

Crodacol-CAT

Cyclal cetyl alcohol

1-Hexanedecanol

Cetalol CA

Crodacol C

Elfacos C

Fancol CA

Lipocol C

Loxanol K

n-Hexadecyl alcohol

Siponol CC

1-Hexadecanol

Atalco C

Cetyl alcohol NF

Cetyl alcohol, analytical standard

Hexadecyl alcohol, normal

Lanol C

Rita CA

1-Hexadecyl alcohol

ACMC-1AJXA

Loxanol K extra

n-Cetyl alcohol

SSD RP

1-Cetanol

16-Hexadecanol

CHEMBL706

Crodacol C95NF

Siponol wax-A

1-Hexadecyl alc

C16 alcohol

Crodacol C70

Eutanol G16

n-1-Hexadecanol

936JST6JCN

Adol 52NF

Alfol 16RD

Cetyl alcohol (hexadecanol)

Epal 16NF

Hexadecan-1-ol

Hexadecanol (VAN)

Hyfatol 16

Lanette 16

Laurex 16

Lorol C16

LorolL 24

SCHEMBL3381

AC1L1E85

Adol 52

Adol 54

Aldol 54

Alfol 16

Epal 16

KSC206A8T

Lorol 24

ARONIS25150

Crodacol C95 NF

Dehydag wax 16

NSC4194

Product 308

UNII-936JST6JCN

Adol 520

Alcohol C-16

Cachalot C-50

Cachalot C-51

Cachalot C-52

Cetanol (TN)

CTK1A6089

HMDB03424

n-Hexadecan-1-ol

Philcohol 1600

Adol 52 NF

Cetyl alcohol (NF)

Cetyl alcohol [NF]

Dytol F-11

Kalcol 6098

NE10353

UNII-2DMT128M1S component BXWNKGSJHAJOGX-UHFFFAOYSA-N

UNII-S4827SZE3L component BXWNKGSJHAJOGX-UHFFFAOYSA-N

bmse000487

C00823

Cetyl alcohol, European Pharmacopoeia (EP) Reference Standard

D00099

Fatty alcohol(C16)

HMS3652H05

HSDB 2643

1-Hexadecanol, >=99%

Cachalot C-50 NF

CO-1670

CO-1695

CS-D1348

DTXSID4027991

FEMA Number 2554

LP003429

LS-2793

NSC 4194

NSC-4194

SBB060167

SSD (Salt/Mix)

ST075158

STL283943

UNII-B1K89384RJ component BXWNKGSJHAJOGX-UHFFFAOYSA-N

1-Hexadecanol, 95%

Cetanol (JP17)

Cetyl Alcohol, pharmaceutical secondary standard; traceable to USP and PhEur

Cetyl alcohol, United States Pharmacopeia (USP) Reference Standard

CHEBI:16125

DSSTox_CID_7991

Loxiol VPG 1743

ZINC8214519

AK-48193

ANW-28459

Caswell No. 165D

DSSTox_GSID_27991

Hyfatol 16-95

SC-18656

ST2415347

TRA0159983

DSSTox_RID_78633

LMFA05000061

MFCD00004760

SSD RP (Salt/Mix)

AI3-00755

KB-218917

RTR-036616

TR-036616

AKOS005287456

Alcohols, C14-18

EPA Pesticide Chemical Code 001508

xOemicro (1/4)

BRN 1748475

FEMA No. 2554

I14-18880

Michel XO-150-16

EN300-19351

Tox21_111609

Tox21_300325

124-29-8

F0001-1047

1-Hexadecanol, ReagentPlus(R), 99%

8014-51-5

8023-37-8

8032-16-4

8032-17-5

8032-89-1

MCULE-9457426256

NCGC00159368-02

NCGC00159368-03

NCGC00159368-04

NCGC00159368-05

NCGC00159368-06

NCGC00254286-01

AB01566915_01

Cetyl alcohol, SAJ special grade, >=98.0%

EINECS 252-964-9

EINECS 253-149-0

29354-98-1

36653-82-4

51260-59-4

55069-45-9

Cetyl alcohol, Selectophore(TM), >=99.0%

Cetyl alcohol, puriss., 95.0%

SR-01000944409

Tox21_111609_1

1-Hexadecanol, Vetec(TM) reagent grade, 94%

CAS-36653-82-4

MolPort-001-783-290

1173838-87-3

1-E(R)AuIe (1/4)

SR-01000944409-1

19141-82-3 (aluminum salt)

Cetyl alcohol, puriss., >=99.0% (GC)

S4173,36653-82-4

4-01-00-01876 (Beilstein Handbook Reference)

810F139F-C57E-4DF1-916A-A320AD0DAF4D

InChI=1/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H

The Henry's Law constant for 1-hexadecanol is estimated as 4.6X10-5 atm-cu m/mole(SRC) derived from its vapor pressure, 6.0X10-6 mm Hg(1), and water solubility, 4.1X10-2 mg/L(2). This Henry's Law constant indicates that 1-hexadecanol 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 23 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 12 days(SRC). However, volatilization from water surfaces is expected to be attenuated by adsorption to suspended solids and sediment in the water column. The estimated volatilization half-life from a model pond is 1.8 years if adsorption is considered (4). 1-Hexadecanol's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). 1-Hexadecanol 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 supplement 5 (1995) (2) Yalkowsky SH, He Y; Handbook of Aqueous Solubility Data. CRC Press LLC, Boca Raton, FL. p. 1063 (2003) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (4) US EPA; EXAMS II Computer Simulation (1987)

The Koc of 1-hexadecanol is estimated as 25,000(SRC), using a water solubility of 4.122X10-2(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 1-hexadecanol is expected to be immobile in soil.
Literature: (1) Yalkowsky SH, He Y; Handbook of Aqueous Solubility Data. CRC Press LLC, Boca Raton, FL. p. 1063 (2003) (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)

Capronaldehyde

Caproaldehyde

Hexanaldehyde

Hexylaldehyde

Kapronaldehyd

Hexaldehyde

JARKCYVAAOWBJS-UHFFFAOYSA-N

n-Caproylaldehyde

Caproic aldehyde

HEXANAL

Hexoic aldehyde

n-Caproaldehyde

n-Capronaldehyde

n-Hexylaldehyde

Hexyl aldehyde

n-Hexaldehyde

Caproaldehyde, Hexyl aldehyde

Hexanal, analytical standard

n-Caproic aldehyde

n-Hexanal

AC1Q2VPQ

1-hexanone

6-OXOHEXYL

Aldehyde C6

C6 aldehyde

1-Hexanal

Kapronaldehyd [Czech]

AC1L1LZ0

9DC2K31JJQ

ACMC-1BFR4

Aldehydes, C6

C6H12O

Hexanal (natural)

PubChem3077

Aldehyde C-6

E-2-hexanal

KSC353M9N

7134AH

hexan-1-al

n-C5H11CHO

NSC2596

SCHEMBL22263

UN1207

UNII-9DC2K31JJQ

CTK2F3696

Hexanal, 98%

HMDB05994

HSDB 560

WLN: VH5

CHEMBL280331

NE10466

RP18712

CCRIS 3219

n-HEXALDEHYDE, 98%

DTXSID2021604

FEMA Number 2557

LP094954

LP104070

LS-2339

NSC 2596

NSC-2596

OR012182

STL280331

UN 1207

A835388

CHEBI:88528

DSSTox_CID_1604

ZINC1641021

AN-23753

ANW-35172

CJ-05867

CJ-26448

DSSTox_GSID_21604

EBD3061058

SC-06151

BDBM50028824

DSSTox_RID_76231

LMFA06000109

MFCD00007027

ZINC01641021

AI3-15364

DB-054893

RTR-022440

TR-022440

AKOS009156478

J-660017

S14-1025

BRN 0506198

FEMA No. 2557

FT-0631290

FT-0669191

TRA-0203532

66-25-1

EN300-33498

Hexanal, natural, >=90%, FG

Hexanal, natural, >=95%, FG

Tox21_201933

Tox21_303342

CAS-66-25-1

Hexanal, >=97%, FCC, FG

Hexaldehyde [UN1207] [Flammable liquid]

NCGC00249137-01

NCGC00257270-01

NCGC00259482-01

EINECS 200-624-5

EC 200-624-5

Hexaldehyde [UN1207] [Flammable liquid]

MolPort-001-769-760

4-01-00-03296 (Beilstein Handbook Reference)

The Henry's Law constant for hexaldehyde is 2.13X10-4 atm-cu m/mole(1). This Henry's Law constant indicates that hexaldehyde 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 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)(2) is estimated as 5 days(SRC). Hexaldehyde's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Hexaldehyde is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 11.3 mm Hg(3).
Literature: (1) Buttery RG et al; J Agric Food Chem 17: 385-9 (1969) (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)

The Koc of hexaldehyde is estimated as 50(SRC), using a log Kow of 1.78(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that hexaldehyde is expected to have high 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. 24 (1995) (2) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.1. Nov, 2012. Available from, as of May 18, 2015: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm (3) Swann RL et al; Res Rev 85: 17-28 (1983)

Schwefelkohlenstoff

Carbondisulphide

Koolstofdisulfide

disulfidocarbon

Dithiocarbonic anhydride

Dithioxomethane

Kohlendisulfid

methanedithione

Sulfocarbonic anhydride

Sulphocarbonic anhydride

Carbon bisulfuret

Carbon bisulphide

Carbon disulphide

carbon-disulphide

Dithioxomethane #

Kohlendisulfid (schwefelkohlenstoff)

QGJOPFRUJISHPQ-UHFFFAOYSA-N

Weeviltox

Wegla dwusiarczek

Carbon bisulfide

CARBON DISULFIDE

Carbon sulphide

Koolstofdisulfide (zwavelkoolstof)

Carbon disulfide cation

Carbon-disulphide-

Schwefelkohlenstoff [German]

Solfuro di carbonio

Sulfure de carbone

Sulphuret of carbon

Weevil-Tox

AC1L1MBX

AC1Q7EYQ

Alcohol of sulfur

Carbon disulfide, ACS reagent

Carbon disulfide, CP

Kohlendisulfid (schwefelkohlenstoff) [German]

Wegla dwusiarczek [Polish]

HSDB 52

Koolstofdisulfide (zwavelkoolstof) [Dutch]

KSC377M2H

ACMC-20ali2

UN1131

C1955

Carbon disulfide, spectrophotometric grade, >=99%

Carbone (sulfure de)

Carbone (sulfuro di)

Carbonio (solfuro di)

CTK2H7623

Solfuro di carbonio [Italian]

RP18362

C19033

Carbon disulfide [BSI:ISO]

CCRIS 5570

RCRA waste number P022

S54S8B99E8

300030XA

Carbon disulfide, anhydrous, >=99%

Carbon sulfide (CS2)

CHEMBL1365180

DTXSID6023947

IN002279

LS-1657

OR261913

UN 1131

300030X

CHEBI:23012

DSSTox_CID_3947

NCI-C04591

Sulfure de carbone [ISO-French]

UNII-S54S8B99E8

AN-23840

DSSTox_GSID_23947

Caswell No. 162

DSSTox_RID_77238

AI3-08935

RTR-024207

TR-024207

AKOS009075983

Carbon disulfide solution, 5 M in THF

Carbonio (solfuro di) [Italian]

EPA Pesticide Chemical Code 016401

RCRA waste no. P022

BRN 1098293

Carbone (sulfure de) [French]

FT-0083177

FT-0623475

75-15-0

I14-19641

Tox21_111082

Tox21_201168

Carbon disulfide, ACS reagent, >=99.9%

CAS-75-15-0

Carbon disulfide, for HPLC, >=99.9%

Carbon disulfide, JIS special grade, >=99.0%

NCGC00091108-01

NCGC00091108-02

NCGC00258720-01

Carbon disulfide, SAJ first grade, >=98.0%

EINECS 200-843-6

12539-80-9

Carbon disulfide [UN1131] [Flammable liquid]

Carbon disulfide solution, 5000 mug/mL in methanol, analytical standard

Carbon disulfide solution, certified reference material, 5000 mug/mL in methanol

355120-85-3

Carbon disulfide, ReagentPlus(R), purified by redistillation, >=99.9%

MolPort-001-768-563

Carbon disulfide [UN1131] [Flammable liquid]

Carbon disulfide, p.a., 99.5%

Carbon disulfide, purum, >=99.0% (GC)

Carbon disulfide, ReagentPlus(R), low benzene, >=99.9%

Carbon disulfide, puriss., >=99.5% (GC)

Carbon-12C disulfide, 99.9 atom % 12C

Carbon disulfide, HPLC, 99.8% min. 1L

4-03-00-00395 (Beilstein Handbook Reference)

Carbon disulfide, puriss., low in benzene, >=99.5% (GC)

Carbon disulfide, puriss. p.a., >=99.9% (GC)

Carbon disulfide, for IR spectroscopy, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99.9% (GC)

The Henry's Law constant for carbon disulfide is 1.44X10-2 atm-cu m/mole at 24 deg C(1). This Henry's Law constant indicates that carbon disulfide is expected to volatilize rapidly from water surfaces(2). 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) (2) is approximately 2.6 hours(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) (2)is approximately 3.5 days(SRC). Carbon disulfide's Henry's Law constant(1) indicates that volatilization from moist soil surfaces is expected to occur(SRC). The potential for volatilization of carbon disulfide from dry soil surfaces may exist(SRC) based upon the vapor pressure of 359 mm Hg(3).
Literature: (1) Elliot S; Atmos Environ 23: 1977-80 (1989) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Yaws CL; Handbook of Vapor Pressure, Vol 1, Houston,TX: Gulf Pub Co (1994)

The Koc of carbon disulfide is estimated as approximately 270(SRC), using a log Kow of 1.94(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that carbon disulfide is expected to have moderate mobility in soil(SRC). The avg adsorption of carbon disulfide after 10 minutes by 4 air-dried soils was 46% but only 12% by the same soils at 50% water-holding capacity(4). However, after 8 hr the rate of adsorption was greater by moist soil, but only when the soil was unsterilized(4). Further experiments suggest that this 'adsorption' in moist soils is the result of microbial action(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 3 (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) (4) Bremner JM, Banwart WL; Soil Biol Biochem 8: 79-83 (1976)

isoborneol acetate

Isobornyl acetate

KGEKLUUHTZCSIP-UHFFFAOYSA-N

Pichtosin

Bornyl ethanoate

L-BORNYLACETATE

BORNYL ACETATE

Acetic acid isobornyl

Bornyl acetic ether

endo-bornyl acetate

iso-bornyl acetate

AC1Q1LBC

AC1Q1LBD

Borneol, acetate

L-bornyl acetate

2-Camphanol acetate

2-Camphanyl acetate

D,L-Isobornyl Acetate

endo-2-Camphanyl ethanoate

AC1L1MK0

AC1Q624O

KSC643A2L

M580

BORNYL ACETATE (ISO)

CTK5E3025

endo-2- camphanol acetate

V0308

SCHEMBL117760

HMS3264P09

AK305643

BBL033932

BT000267

CHEMBL1439452

Jsp001645

LS-2587

NSC163480

NSC407158

NSC759844

OR338986

STK079562

AN-19137

AN-22962

AN-23897

FCH1484150

KB-00126

TRA0020925

TRA0095269

(-)-Bornyl acetate

(+)-Bornyl acetate

BB_NC-0749

MFCD00867808

AI3-00665

CCG-213841

DB-066148

DB-072157

NSC 407158

NSC-163480

NSC-407158

NSC-759844

RTR-009478

ST50308180

TR-009478

AKOS005392232

4CH-024769

FEMA No. 2159

FT-0623175

FT-0690920

L-(-)-Bornyl acetate

76-49-3

I14-13399

BBV-42867202

NCI60_020169

125-12-2

5655-61-8

MCULE-5021705670

NCGC00159354-02

NCGC00159354-03

AB01563199_01

EINECS 200-964-4

20347-65-3

28974-17-6

71424-71-0

92618-89-8

Pharmakon1600-01502510

SR-01000944256

(1,7,7-trimethylnorbornan-2-yl) acetate

MolPort-000-743-453

SR-01000944256-1

1,7-Trimethylbicyclo[2.2.1]heptan-2-ol acetate

1,7,7-Trimethylbicyclo(2.2.1)heptan-2-ol acetate

1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl acetate

1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate

endo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl acetate

1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate #

(1,7,7-trimethyl-6-bicyclo[2.2.1]heptanyl) acetate

(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) acetate

1,7,7-Trimethylbicyclo(2.2.1)heptan-2-yl acetate, endo-

Acetic acid, 1,7,7-trimethyl-bicyclo[2.2.1]hept-2-yl ester

Bicyclo[2.2.1]heptan-2-ol,7,7-trimethyl-, acetate, endo-

endo-(1S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl acetate

Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, acetate, endo-

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, endo-

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, acetate, (1S,2R,4S)-

BICYCLO[2.2.1]HEPTAN-2-OL,1,7,7-TRIMETHYL-, 2-ACETATE, (1S,2R,4S)-

Bicyclo(2.2.1)heptan-2-ol, 1,7,7-trimethyl-, acetate, (1R,2S,4R)-rel-

Bicyclo[2.2.1]heptan-2-ol,1,7,7-trimethyl-, 2-acetate, (1R,2S,4R)-rel-

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-acetate, (1S,2R,4S)-

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-acetate, (1R,2R,4R)-rel-

Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, 2-acetate, (1R,2S,4R)-rel-

CDOSHBSSFJOMGT-UHFFFAOYSA-N

Linalool

Linanool

Linolool

Linalol

Linalool, primary pharmaceutical reference standard

LINALYL ALCOHOL

Natural Linalool

Phantol

allo-Ocimenol

beta-Linalool

Linalool, analytical standard

Howood Oil

p-Linalool

AC1L1MRY

AC1Q1NVD

AC1Q1NVE

Linalool ex orange oil

AC1Q2BP3

Linalool (natural)

Linalool ex ho oil

.beta.-Linalool

GTPL2469

KSC377K8J

LINALOOL EX BOIS DE ROSE

CHEMBL25306

NSC3789

SCHEMBL20316

(S)-Linalol

CTK2H7584

HSDB 645

L0048

Linalool, 97%

LINOLOOL (D)

AC-551

ACMC-209pf1

Linalool ex bois de rose oil

RP21877

C03985

CCRIS 3726

CCRIS 6557

HMS2268E18

Linalool, .beta.

Linalool, certified reference material, TraceCERT(R)

BBL027734

BC207603

BT000180

DTXSID7025502

FEMA Number 2635

LP067292

LS-1752

NSC 3789

NSC-3789

OR341488

SBB012353

ST069326

STL373777

( )-linalool

CHEBI:17580

DSSTox_CID_5502

AK-50127

AN-15757

AN-22986

ANW-37211

Caswell No. 526A

DSSTox_GSID_25502

FCH1115719

LS-97796

SC-74998

BB_NC-0123

DSSTox_RID_77812

MFCD00008906

AI3-00942

DB-062552

KB-179981

RTR-030706

TR-030706

WLN: 1U1XQ1&3UY1&1

( -)-Linalool

(+-)-Linalool

AKOS015901617

BB_NC-00123

EPA Pesticide Chemical Code 128838

Q-201306

2,7-octadiene-6-ol

3,6-octadien-3-ol

BRN 1721488

FEMA No. 2635

FT-0614785

MLS002152908

SMR000112394

78-70-6

I14-13929

2,7-dien-6-ol

3,6-dien-3-ol

Tox21_201658

Tox21_303037

(+/-) LINALOOL

Linalool, >=97%, FCC, FG

CAS-78-70-6

MCULE-2407576698

NCGC00091688-01

NCGC00091688-02

NCGC00091688-03

NCGC00091688-04

NCGC00257060-01

NCGC00259207-01

EINECS 201-134-4

EINECS 204-811-2

EINECS 245-083-6

11024-20-7

22564-99-4

LINALOOL, (+-)-

EC 201-134-4

MolPort-001-783-101

(.+/-.)-Linalool

2,6-Dimethyl-2,7-octadien-6-ol

2,6-Dimethyl-2,7-octadiene-6-ol

2,6-Dimethylocta-2,7-dien-6-ol

3,7-Dimethyl-1,6-octadien-3-ol

3,7-Dimethyl-1,6-octadien-3-ol|

3,7-Dimethylocta-1,6-dien-3-ol

dl-3,7-Dimethyl-3-hydroxy-1,6-octadiene

CU-01000013132-2

WLN: 1Y1&U3XQ1&1U1 -,-

1,6-Octadien-3-ol,3,7-Dimethyl-

3,7-dimethyl-octa-1,6-dien-3-ol

DL -3,7-Dimethyl-3-hydroxy-1,6-octadiene

1,6-Octadien-3-ol, 3,7-dimethyl-

2,7-Octadien-6-ol, 2,6-dimethyl-

0-01-00-00462 (Beilstein Handbook Reference)

(?)-3,7-Dimethyl-1,6-octadien-3-ol

(1)-3,7-Dimethyl-1,6-octadien-3-ol

1, 3,7-dimethyl-, (-)-

(+/-)-3,7-Dimethyl-3-hydroxy-1,6-octadiene

(+/-)-3,7-Dimethyl-1,6-octadien-3-ol

1,6-Octadien-3-ol, 3,7-dimethyl-, (R)-

1,6-Octadien-3-ol, 3,7-dimethyl-, (3R)-

1,6-Octadien-3-ol, 3,7-dimethyl-, (3S)-

1,6-OCTADIEN-3-OL, 3,7-DIMETHYL-, (-)-

The Henry's Law constant for linalool is 2.15X10-5 atm-cu m/mole at 25 deg C(1). This Henry's Law constant indicates that linalool 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 54 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 20 days(SRC). Linalool's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Linalool exists as a liquid environmentally at standard temperature and pressure, therefore, it is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.159 mm Hg(3).
Literature: (1) Altschuh J et al; Chemosphere 39: 1871-87 (1999) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Li J et al; Environ International 24: 353-58 (1998)

Using a structure estimation method based on molecular connectivity indices(1), the Koc of linalool can be estimated to be 75(SRC). According to a classification scheme(2), this estimated Koc value suggests that linalool is expected to have high mobility in soil.
Literature: (1) US EPA; Estimation Program Interface (EPI) Suite. Ver. 4.11. Nov, 2012. Available from, as of Nov 20, 2015: http://www2.epa.gov/tsca-screening-tools (2) Swann RL et al; Res Rev 85: 17-28 (1983)

Phosphosulfurized alpha-pinene

ALPHA-PINENEPOLYMER

alphapinene

GRWFGVWFFZKLTI-UHFFFAOYSA-N

Cyclic dexadiene

alpha-Pinene, phosphosulfurized

Pinene isomer

alpha pinene

ALPHA-PINENE

Sylvapine A

Acintene A

Acitene A

Wilt Pruf

Alpha Pinene PF

DL-ALPHA-PINENE

2-Pinene

PINENE, ALPHA

1R-alpha-Pinene

AC1L1N0D

alpha-pinene, pinene

alpha-Pinene(dextro)

1R-a-Pinene

.alpha.-Pinene

alpha-Pinene (natural)

NSC7727

pin-2-ene

UN2368

CCRIS 697

CTK5E7908

HMDB06525

HSDB 720

CHEMBL442565

NSC94522

NSC94523

PC 500

alpha [D] Pinene

alpha [L] Pinene

C09880

BT000143

DTXSID4026501

FEMA Number 2902

LS-2348

NSC 7727

NSC-7727

OR038360

OR246844

OR249294

Pinene, .alpha.

SBB060477

UN 2368

1R-.alpha.-Pinene

1S-.alpha.-Pinene

CHEBI:36740

DSSTox_CID_6501

AN-19420

AN-19426

AN-42193

DSSTox_GSID_26501

NSC-94522

NSC-94523

SC-18193

DSSTox_RID_78126

PINENE, ALPHA (D)

PINENE, ALPHA (L)

AI3-24594

ST51046656

AKOS000121239

Q-201582

(+)-a-Pinene

BRN 3194807

FEMA No. 2902

FT-0604379

FT-0604414

FT-0622197

FT-0698080

pin-2(3)-ene

(R)-.alpha.-Pinene

80-56-8

(+-)-alpha-pinene

Tox21_110996

Tox21_200108

Tox21_303385

1R-(+)-alpha-pinene

alpha-Pinene, phosphorus pentasulfide reaction product (4:1)

DL-Pin-2(3)-ene

CAS-80-56-8

1R-(+)-a-pinene

MCULE-3589656574

NCGC00090682-01

NCGC00090682-02

NCGC00257379-01

NCGC00257662-01

(+-)-2-pinene

(+/-)-alpha-Pinene

EINECS 201-291-9

EINECS 219-445-9

EINECS 267-032-7

25766-18-1

39388-04-0

39423-40-0

50815-61-7

53569-35-0

56833-58-0

57762-87-5

67762-73-6

68411-25-6

72510-05-5

102640-64-2

103657-08-5

459844-87-2

alpha-Pinene [UN2368] [Flammable liquid]

(+/-)-2-Pinene

MolPort-003-926-536

(1R)-(+)-a-Pinene

(+)-Pin-2(3)-ene

2,6-Trimethylbicyclo[3.1.1]-2-heptene

(.+/-.)-.alpha.-Pinene

2,6,6-Trimethylbicyclo(3.1.1)hept-2-ene

2,6,6-Trimethylbicyclo[3.1.1]-2-heptene

2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

4,6,6-trimethylbicyclo[3.1.1]hept-3-ene

4,6,6-Trimethylbicyklo(3,1,1)hept-3-en

Bicyclo[3.1.1]hept-2-ene,6,6-trimethyl-

2,6-Trimethylbicyclo[3.1.1]-2-hept-2-ene

2,6,6-trimethyl-Bicyclo(3.1.1)hept-2-ene

2,6,6-trimethyl-bicyclo[3.1.1]hept-2-ene

2-Pinene, (1S,5S)-(-)-

2,6,6-Trimethyl bicyclo-(3,1,1)-2 heptene

Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl

Bicyclo[3.1.1]hept-2-ene,2,6,6-trimethyl-

2,6,6-Trimethylbicyclo(3.1.1)-2-hept-2-ene

4,6,6-Trimethylbicyklo(3,1,1)hept-3-en [Czech]

Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, phosphosulfurized

Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-

Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-

(1R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

(1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, homopolymer

Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1R)-

Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (1S)-

Bicyclo[3.1.1]hept-2-ene, 2,6,6-trimethyl-, (.+/-.)-

The Henry's Law constant for alpha-pinene is estimated as 0.29 atm-cu m/mole(SRC) derived from its vapor pressure, 4.75 mm Hg(1), and water solubility, 2.49 mg/L(2). This Henry's Law constant indicates that alpha-pinene 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 3 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 5 days(SRC). alpha-Pinene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of alpha-pinene from dry soil surfaces may exist based upon a vapor pressure of 4.75 mm Hg(1).
Literature: (1) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals: Data Compilation. Design Inst Phys Prop Data, Amer Inst Chem Eng NY, NY: Hemisphere Pub Corp (1989) (2) Li J, Perdue EM; Physicochemical properties of selected monoterpenes. Pre-print extended abstract, Presented before the Division of Environmental Chemistry, Amer. Chem. Soc., Anaheim, CA, April 2-7, 1995 (1995) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)

ALMOST INSOLUBLE IN PROPYLENE GLYCOL & GLYCERINE
Literature: Fenaroli's Handbook of Flavor Ingredients. Volume 2. Edited, translated, and revised by T.E. Furia and N. Bellanca. 2nd ed. Cleveland: The Chemical Rubber Co., 1975., p. 486
Literature: #Sol in alcohol, chloroform, ether, glacial acetic acid, fixed oils
Literature: Lewis, R.J. Sax's Dangerous Properties of Industrial Materials. 10th ed. Volumes 1-3 New York, NY: John Wiley & Sons Inc., 1999., p. 2970
Literature: #In water, 2.49 mg/L at 25 deg C
Literature: Li J, Perdue EM; Physicochemical Properties of Selected Monoterpenes. Pre-print Extended Abstract, Presented Before The Division of Environmental Chemistry, Amer Chem Soc, Anaheim, Ca: April 2-7 (1995)

The Koc of alpha-pinene is estimated as 2,600(SRC), using a water solubility of 2.49 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that alpha-pinene is expected to have slight mobility in soil.
Literature: (1) Li J, Perdue EM; Physicochemical properties of selected monoterpenes. Pre-print extended abstract, Presented before the Division of Environmental Chemistry, Amer. Chem. Soc., Anaheim, CA, April 2-7, 1995 (1995) (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)

o-Hydroxyethylbenzene

ETHYLPHENOL

ortho-ethylphenol

IXQGCWUGDFDQMF-UHFFFAOYSA-N

Phlorol

Florol

o-Ethylphenol

2-phenethylalcohol

AC1Q2UBR

AC1L1NRS

JZ1

2-ETHYLPHENOL

1-ethylphenol

o-Ethyl phenol

PHENOL,ETHYL-

AC1Q2T5V

PubChem3871

2-Ethyl-phenol

2-ethyl phenol

ACMC-1CHE2

U021

KSC205O9N

Phenol, ethyl-

1-Ethyl-2-hydroxybenzene

Florol [Czech]

1-Hydroxy-2-ethylbenzene

SCHEMBL51108

E0160

CTK1A5796

SGCUT00114

UNII-C27Y543KVA component IXQGCWUGDFDQMF-UHFFFAOYSA-N

RP19476

BIDD:ER0661

NSC10112

CHEMBL321029

STR06133

HSDB 5267

355O0P4JU7

CCRIS 6038

C14385

A15993

Phenol, o-ethyl-

OR010954

LS-1904

DTXSID1022479

OR248714

1-ethyl-2-hydroxy-benzen

AK114273

UNII-355O0P4JU7

ZINC1706027

2-Ethylphenol, 99%

DSSTox_CID_2479

CHEBI:34275

Phenol, 2-ethyl-

SC-46756

AJ-30612

AN-17756

AN-24182

ANW-39417

CJ-06729

CJ-28837

NSC-10112

NSC 10112

KB-23780

DSSTox_GSID_22479

ZINC01706027

DSSTox_RID_76599

MFCD00002249

DB-021047

ST51054295

ST24040555

to_000008

RTR-033038

2-Ethylphenol, PESTANAL(R), analytical standard

TR-033038

AKOS000119353

J-509333

FT-0612290

BRN 1099397

4CH-024566

90-00-6

Benzene, 1-ethyl-2-hydroxy-

Tox21_202327

Tox21_302885

Z1262253000

CAS-90-00-6

NCGC00259876-01

MCULE-1491819809

NCGC00091780-01

NCGC00091780-02

NCGC00256439-01

EINECS 201-958-4

25429-37-2

MolPort-001-791-601

47721-EP2305625A1

47721-EP2311811A1

4-06-00-03011 (Beilstein Handbook Reference)

InChI=1/C8H10O/c1-2-7-5-3-4-6-8(7)9/h3-6,9H,2H2,1H

The Henry's Law constant for 2-ethylphenol is estimated as 4.6X10-6 atm-cu m/mole(SRC) from its experimental values for vapor pressure, 0.153 mm Hg at 25 deg C(1), and water solubility, 5340 mg/L at 25 deg C(2). This value indicates that 2-ethylphenol will volatilize from water surfaces(3,SRC). 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) is estimated as approximately 9 days(3,SRC). The 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 68 days(3,SRC). 2-Ethylphenol's values for vapor pressure(1) and estimated Henry's Law constant(1,2,SRC) indicate that volatilization from dry and moist soil surfaces is possible, but is not likely to be a major fate process for this compound(SRC).
Literature: (1) Biddiscombe DP et al; J Chem Soc. pp. 5764-8 (1963) (2) Mueller M, Klein W; Chemosphere 25: 769-82 (1992) (3) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington DC: Amer Chem Soc pp. 15-1 to 15-29 (1990)

The Koc of 2-ethylphenol is estimated as approximately 530(SRC), using a measured log Kow of 2.47(1) and a regression-derived equation(2,SRC). According to a recommended classification scheme(3), this estimated Koc value suggests that 2-ethylphenol has moderate to low mobility in soil(SRC).
Literature: (1) Hansch C, Leo AJ; Pomona College Medicinal Chemistry Project. Claremont, CA. Log P Database (1987) (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)

Homoguaiacol

Homocatechol monomethyl ether

Valspice

PETRWTHZSKVLRE-UHFFFAOYSA-N

Rohkcrsol

Creosol

Kreosol

p-Methylguaiacol

Cresolum drudum

4-Methylguaiacol

p-Creosol

W9GW1KZG6N

4-Methyl guaiacol

Nature 4-Methyl guaiacol

AC1Q46AW

AC1L1O3Y

UNII-W9GW1KZG6N

4-Hydroxy-3-methoxytoluene

3-Methoxy-4-hydroxytoluene

R585

Kreosol [German]

2-Hydroxy-5-methylanisole

KSC495C3R

4-Methyl-2-methoxyphenol

2-Methoxy-p-cresol

SCHEMBL92236

2-METHOXY-4-METHYLPHENOL

NSC4969

CTK3J5138

M0114

ACMC-209rm9

2-Methoxy-4-methylphenol, analytical standard

2-Methoxy-4-cresol

NSC 4969

CHEMBL3182715

NSC-4969

OR000832

SBB008258

2-methoxy-4-methyl-phenol

2-methoxy-4-methyl phenol

DTXSID6047105

FR-1124

M-5048

ZINC3875629

CHEBI:89886

AK-75601

1-Hydroxy-2-methoxy-4-methylbenzene

2-2-Methoxy-4-methylphenol

ST2410076

SC-15288

4-Hydroxy-3-methoxy-1-methylbenzene

AJ-46447

AN-24263

ANW-40063

LS-55413

CJ-11016

KB-24889

DSSTox_GSID_47105

DSSTox_CID_27105

DSSTox_RID_82115

MFCD00002378

ZINC03875629

RTR-029283

TR-029283

Phenol, 4-methyl-2-methoxy

p-Cresol, 2-methoxy-

ST50828305

AI3-15891

2-Methoxy-4-methylphenol (Methyl guaiacol)

I01-2278

Q-100894

AKOS000120520

FEMA No. 2671

FT-0612795

2-Methoxy-4-methylphenol, >=98%

BRN 1862340

93-51-6

Phenol, 3-methoxy-4-methyl-

Tox21_302681

Phenol, 2-methoxy-4-methyl-

AZ0001-0503

F0001-2237

CAS-93-51-6

NCGC00256731-01

MCULE-1126785638

EINECS 202-252-9

2-Methoxy-4-methylphenol, >=98%, FG

MolPort-001-770-303

2-Methoxy-4-methylphenol, natural, 97%, FG

InChI=1/C8H10O2/c1-6-3-4-7(9)8(5-6)10-2/h3-5,9H,1-2H