Results for:
PubChem ID: 7966

Cyclohexanol

Mass-Spectra

Compound Details

Synonymous names
CYCLOHEXANOL
108-93-0
Cyclohexyl alcohol
1-Cyclohexanol
Hexahydrophenol
Hydrophenol
Hydroxycyclohexane
Hexalin
Adronal
Hydralin
Naxol
Adronol
Anol
Cicloesanolo
Cykloheksanol
Phenol, hexahydro-
Cicloesanolo [Italian]
Cykloheksanol [Polish]
Cyclohexan-1-ol
HSDB 61
CCRIS 5896
NSC 403656
cyclohexyl-alcohol
EINECS 203-630-6
UNII-8E7S519M3P
BRN 0906744
DTXSID4021894
CHEBI:18099
AI3-00040
8E7S519M3P
MFCD00003855
NSC-403656
DTXCID001894
EC 203-630-6
4-06-00-00020 (Beilstein Handbook Reference)
CXL
Cyclohexanols
Ciclohexanol
Hydroxycyclohexane; NSC 403656; NSC 54711; Naxol; Phenol, hexahydro-
CAS-108-93-0
Cylcohexanol
Cyclohexane, hydroxy-
BDBM5
CYCLOHEXANOL [MI]
HEXALIN (ALCOHOL)
bmse000431
WLN: L6TJ AQ
CYCLOHEXANOL [HSDB]
SCHEMBL5545
MLS001055343
BIDD:ER0291
CHEMBL32010
Cyclohexanol, p.a., 99.0%
Cyclohexanol, analytical standard
HMS3039K08
Tox21_201481
Tox21_302803
BBL013186
Cyclohexanol, ReagentPlus(R), 99%
NSC403656
STL163965
AKOS000119038
DB03703
MCULE-8217921343
RP10050
NCGC00090982-01
NCGC00090982-02
NCGC00256434-01
NCGC00259032-01
SMR000677941
Cyclohexanol, puriss., >=99.0% (GC)
Cyclohexanol, SAJ first grade, >=95.0%
DB-040851
CS-0017198
Cyclohexanol, JIS special grade, >=98.0%
NS00010075
Cyclohexanol, Vetec(TM) reagent grade, 98%
EN300-19310
C00854
Q423282
Q-200903
F0001-0184
Z104473498
Microorganism:

Yes

IUPAC namecyclohexanol
SMILESC1CCC(CC1)O
InchiInChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2
FormulaC6H12O
PubChem ID7966
Molweight100.16
LogP1.2
Atoms7
Bonds0
H-bond Acceptor1
H-bond Donor1
Chemical Classificationalcohols
CHEBI-ID18099
Supernatural-IDSN0132264

mVOC Specific Details

Boiling Point
DegreeReference
161.84 °C peer reviewed
Volatilization
The Henry's Law constant for cyclohexanol is 4.40X10-6 atm-cu m/mole(1). This Henry's Law constant indicates that cyclohexanol 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 8.4 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 64 days(SRC). Cyclohexanol's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Cyclohexanol is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.657 mm Hg(3).
Literature: (1) Altschuh JR 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) Daubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, DC: Taylor and Francis (1998)
Soil Adsorption
The Koc of cyclohexanol is estimated as 11(SRC), using a log Kow of 1.23(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that cyclohexanol is expected to have very 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. 4.0. Jan, 2009. Available from, as of March 29, 2010: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm. (3) Swann RL et al; Res Rev 85: 17-28 (1983)
Vapor Pressure
PressureReference
0.657 mm Hg at 25 deg CDaubert TE, Danner RP; Physical and Thermodynamic Properties of Pure Chemicals Data Compilation. Washington, D.C.: Taylor and Francis, 1998.
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaPseudomonas FluorescensInhibition of mycelium growth and spore germinationNAFernando et al. 2005
ProkaryotaPseudomonas CorrugataInhibition of mycelium growth and spore germinationNAFernando et al. 2005
ProkaryotaPseudomonas ChlororaphisInhibition of mycelium growth and spore germinationNAFernando et al. 2005
ProkaryotaPseudomonas AurantiacaInhibition of mycelium growth and spore germinationNAFernando et al. 2005
EukaryotaTuber Indicumn/aNASplivallo et al. 2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaPseudomonas Fluorescensn/an/ano
ProkaryotaPseudomonas Corrugatan/an/ano
ProkaryotaPseudomonas Chlororaphisn/an/ano
ProkaryotaPseudomonas Aurantiacan/an/ano
EukaryotaTuber Indicumn/an/ano