Cyclohexanepropanol, alpha,beta-dimethyl-
Basic information
- CAS
63450-10-2- Standard SMILES
CC(O)C(C)CC1CCCCC1- InChIKey
UNFLPVPOSGWAPY-UHFFFAOYSA-N- Molecular formula
- C11H22O
- Average molar mass
- 170.29 g/mol
- Monoisotopic mass
- 170.16706532
Names & identifiers
- Preferred name
- Cyclohexanepropanol, alpha,beta-dimethyl-
- IUPAC
- 4-cyclohexyl-3-methylbutan-2-ol
- English name
- alpha,beta-dimethylcyclohexanepropanol
- Molecular formula
- C11H22O
- Molecular weight
- 170.29
Names & synonyms
alpha,beta-DimethylcyclohexanepropanolCyclohexanepropanol, alpha,beta-dimethyl-3-Methyl-4-cyclohexyl-2-butanolCyclohexanepropanol, .alpha.,.beta.-dimethyl-EINECS 264-167-3DTXSID90886592RefChem:129600DTXCID001025916264-167-34-cyclohexyl-3-methylbutan-2-ol63450-10-2SCHEMBL5182651
Show more names
Cyclohexanepropanol, α,β-dimethyl-α,β-Dimethylcyclohexane-1-propanol
UNFLPVPOSGWAPY-UHFFFAOYSA-NAKOS011021163DB-307592NS00055140EN300-1625966
Database identifiers
- CAS
63450-10-2- PubChem CID
- 112654
- DTXSID
DTXSID90886592- EC Number
- 264-167-3
- Nikkaji
- J349.189G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- EPA Substance Registry System
- Cyclohexanepropanol, .alpha.,.beta.-dimethyl- (63450-10-2)
- 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.
Hazard information
Regulatory InformationChemical: Cyclohexanepropanol, .alpha.,.beta.-dimethyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclohexanepropanol, .alpha.,.beta.-dimethyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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