Results for:
PubChem ID: 7409

1-phenylethanol

Mass-Spectra

Compound Details

Synonymous names
Methylphenylcarbinol
Phenylmethylcarbinol
alpha-Methylbenzenemethanol
methylbenzylalcohol
beta-Phenethylalcohol
Methylphenyl carbinol
alpha-methyl-benzenemethanol
alpha-Phenylethanol
DL-alpha-METHYLPHENYLCARBINOL
Fenyl-methylkarbinol
methylbenzyl alcohol
ALPHA-METHYLBENZYL ALCOHOL
Styrallyl alcohol
WAPNOHKVXSQRPX-UHFFFAOYSA-N
1-hydroxyethylbenzene
alpha-Methyl-benzmethanol
alpha-Phenylethyl alcohol
Styralyl alcohol
Styrene alcohol
a-methylbenzyl alcohol
alpha-Phenethyl alcohol
beta-Phenethyl alcohol
Methyl phenyl carbinol
methyl phenyl methanol
.alpha.-Methylbenzenemethanol
sec-Phenethyl alcohol
.alpha.-Hydroxyethylbenzene
1-Fenylethanol
1-Phenylethanol
alpha-Methyl-benzyl alcohol
1-Phenylethyl alcohol
AC1Q1QWS
AC1Q2BTJ
1-Phenethyl alcohol
DL-sec-Phenethyl alcohol
m ethyl phenyl methanol
Methanol, methylphenyl-
.alpha.-Phenylethanol
(?)-alpha-Methylbenzenemethanol
Benzenemethanol, alpha-methyl-
DL-1-Phenylethanol
.alpha.-Methylbenzyl alcohol
1-phenyl ethanol
1-PHENYL-ETHANOL
AC1L1OP4
Fenyl-methylkarbinol [Czech]
.alpha.-Phenylethyl alcohol
(1-Hydroxyethyl)benzene
1-Phenyl ethyl alcohol
ACMC-1BP1S
Benzenemethanol, ?-methyl-
SCHEMBL2164
.alpha.-Phenethyl alcohol
(+)-Methylphenylcarbinol
KSC180A0N
1-Phenyl-1-ethylalcohol
1-Phenyl-1-hydroxyethane
dl-.alpha.-Methylbenzyl alcohol
LS-24
UN2937
Benzyl alcohol, alpha-methyl-
CHEBI:669
CTK0I0006
M0163
1-phenylethane-1-ol
ACMC-209ct5
ACMC-209d6x
CHEMBL508917
NSC25502
(1)-alpha-Methylbenzyl alcohol
1-Fenylethanol [Czech]
1-phenyl-1-ethanol
1-Phenylethan-1-ol
C07112
CCRIS 2367
DSSTox_CID_859
HSDB 4164
(+) alpha-phenylethanol
1-Phenylethanol, 98%
Benzenemethanol, .alpha.-methyl-
DTXSID1020859
FEMA Number 2685
OR012341
OR115864
OR115865
OR214134
OR238236
OR243591
OR338848
SBB058702
UN 2937
Ethanol, 1-phenyl-
ETHOXY, 1-PHENYL-
NCI-C55685
(S)-1-Phenylethyl alcohol
AK-58033
AN-24496
AN-49209
AN-49366
ANW-40962
DSSTox_GSID_20859
KB-47293
NSC 25502
NSC-25502
SC-01127
SC-01292
TRA0068410
( )-a-Methylbenzyl alcohol
(-)-Methyl phenyl carbinol
(+)-Methyl phenyl carbinol
DSSTox_RID_75830
MFCD00004508
AI3-02936
DB-043114
RTR-005646
RTR-033037
ST24038180
TR-005646
WLN: QY1 & R
( )-1-Phenylethanol
AKOS000121326
AKOS016038258
Benzyl alcohol, .alpha.-methyl-
I01-7503
I14-7357
W-100061
FEMA No. 2685
FT-0613332
FT-0633624
98-85-1
ETHYL, 1-HYDROXY-1-PHENYL-
Tox21_200505
(+/-)-alpha-Methylbenzyl alcohol
alpha-Methylbenzyl alcohol, >=99%, FCC, FG
CAS-98-85-1
MCULE-1985443213
NCGC00248663-01
NCGC00258059-01
(+/-)-sec-Phenethyl Alcohol
EINECS 202-707-1
EINECS 236-361-8
(+/-)-1-Phenylethanol
13323-81-4
alpha-Methylbenzyl alcohol [UN2937] [Poison]
(+/-)-1-Phenylethyl Alcohol
(R)-(+)-sec-PHENYLETHYL ALCOHOL
(S)-(-)-Sec-Phenylethyl alcohol
(S)-(-)-sec-Phenethyl Alcohol
MolPort-001-788-492
alpha-Methylbenzyl alcohol [UN2937] [Poison]
16568-EP2281563A1
16568-EP2298744A2
16568-EP2301918A1
16568-EP2308857A1
16568-EP2316459A1
Benzenemethanol, .alpha.-methyl-, (R)-
BENZENE-D5-METHAN-D-OL,A-(METHYL-D3)- (9CI)
(R)-(+)-1-Phenylethanol, 99%, ChiraSelect(TM)
Microorganism:

Yes

IUPAC name1-phenylethanol
SMILESCC(C1=CC=CC=C1)O
InchiInChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3
FormulaC8H10O
PubChem ID7409
Molweight122.167
LogP1.62
Atoms19
Bonds19
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationBenzenoids Alcohols

mVOC Specific Details

Volatilization
The Henry's Law constant for alpha-methylbenzyl alcohol is estimated as 2.9X10-7 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This value indicates that alpha-methylbenzyl alcohol will not volatilize from water surfaces(2,SRC). Volatilization from either dry or moist soil surfaces is not expected to be a major fate process based on estimated values for vapor pressure, 0.058 mm Hg(3,SRC) and Henry's Law constant(1,SRC).
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
Koc values for alpha-methylbenzyl alcohol were determined for three subsoils: Apison (organic content = 0.11%) had a Koc of 37, Fullerton (organic content = 0.06%) had a Koc of <5, and Dormont (organic content = 1.2%) had a Koc of 52(1). According to a recommended classification scheme(2), these Koc values suggest that alpha-methylbenzyl alcohol has very high mobility in soil, although increasing organic content will act to reduce mobility slightly(SRC).
Literature: (1) Southworth GR, Keller JL; Water Air Soil Poll 28: 239-48 (1986) (2) Swann RL et al; Res Rev 85: 23 (1983)
MS-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Ambifaria LMG 19467Groenhagen et al., 2013
BacteriaChondromyces Crocatusn/aSchulz and Dickschat, 2007
BacteriaChondromyces Crocatus Cm C2n/aSchulz et al., 2004
BacteriaChondromyces Crocatus Cm C5n/aSchulz et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Ambifaria LMG 19467Luria-Bertani medium, Malt ExtractYes
BacteriaChondromyces Crocatusn/an/a
BacteriaChondromyces Crocatus Cm C2n/an/a
BacteriaChondromyces Crocatus Cm C5n/an/a