1-(Cyclohexyloxy)propan-2-ol
Basic information
- CAS
5334-13-4- Standard SMILES
CC(O)COC1CCCCC1- InChIKey
QXNPSEBOTQLKNZ-UHFFFAOYSA-N- Molecular formula
- C9H18O2
- Average molar mass
- 158.24 g/mol
- Monoisotopic mass
- 158.13067981
Names & identifiers
- Preferred name
- 1-(Cyclohexyloxy)propan-2-ol
- IUPAC
- 1-cyclohexyloxypropan-2-ol
Names & synonyms
5334-13-42-Propanol, 1-(cyclohexyloxy)-1-(CYCLOHEXYLOXY)-2-PROPANOL1-(cyclohexyloxy)propan-2-olNSC-23961-cyclohexyloxy-2-propanolNSC2396JSH8T275LSSCHEMBL3108247SCHEMBL4398857SCHEMBL6162778SCHEMBL9315606
Show more names
DTXSID60277453QXNPSEBOTQLKNZ-UHFFFAOYSA-NAKOS011043997DA-421731-(Cyclohexyloxy)-2-propanol, (+/-)-
Database identifiers
- CAS
5334-13-4- PubChem CID
- 220112
- DTXSID
DTXSID60277453- UNII
- JSH8T275LS
- Nikkaji
- J1.629.076I
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 97.7
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Compound notes
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