Basic information
- CAS
18446-93-0- Standard SMILES
CC1CCC(C(C)O)CC1- InChIKey
KAUADGCMTGZSPE-AGALZMSESA-N- Molecular formula
- C9H18O
- Average molar mass
- 142.24 g/mol
- Monoisotopic mass
- 142.13576519
Names & identifiers
- Preferred name
- 1-(4-Methylcyclohexyl)ethanol
- IUPAC
- 1-(4-methylcyclohexyl)ethanol
- English name
- trans-alpha,4-dimethylcyclohexane-1-methanol
- Molecular formula
- C9H18O
- Molecular weight
- 142.24
Names & synonyms
1-(4-methylcyclohexyl)ethanol34884-20-31-(4-methylcyclohexyl)ethan-1-ol18446-94-11-(4-methyl-cyclohexyl)-ethanol18446-93-0trans-alpha,4-Dimethylcyclohexane-1-methanolcis-alpha,4-Dimethylcyclohexanemethanol1-?(4-?Methyl-?cyclohexyl)?-?ethanolCyclohexanemethanol, .alpha.,4-dimethyl-, cis-Cyclohexanemethanol, .alpha.,4-dimethyl-, trans-Cyclohexanemethanol, alpha,4-dimethyl-, cis-
Show more names
(1α,4β)-α,4-Dimethylcyclohexanemethanoltrans-α,4-dimethylcyclohexane-1-methanolCyclohexanemethanol, α,4-dimethyl-, trans-
EINECS 242-328-9EINECS 242-329-41-((trans)-4-methylcyclohexyl)ethanol1-[(1r,4r)-4-methylcyclohexyl]ethan-1-ol1-[(1s,4s)-4-methylcyclohexyl]ethan-1-olCyclohexanemethanol, alpha,4-dimethyl-, trans-SCHEMBL1270431SCHEMBL10162372
Database identifiers
- CAS
18446-93-0、18446-94-1- PubChem CID
- 87646
- DTXSID
DTXSID10885047- EC Number
- 242-328-9、242-329-4
- Nikkaji
- J266.183G、J266.184E
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 92.9
Physicochemical properties
- Boiling point
- 209 · 209.0±8.0 °C(Predicted)
- Density
- 0.891 · 0.891±0.06 g/cm3(Predicted)
- pka
- 15.12 · 15.12±0.20(Predicted)
- EPA Substance Registry System
- 4 · Cyclohexanemethanol, .alpha.,4-dimethyl-, trans- (18446-94-1)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Cyclohexanemethanol, .alpha.,4-dimethyl-, cis-: INACTIVE
Cyclohexanemethanol, .alpha.,4-dimethyl-, trans-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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