2-(Hydroxymethyl)-1-phenylcyclohexan-1-ol
Basic information
- CAS
24927-50-2- Standard SMILES
OCC1CCCCC1(O)c1ccccc1- InChIKey
AEPWPCRJAHECSU-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.13067981
Names & identifiers
- Preferred name
- 2-(Hydroxymethyl)-1-phenylcyclohexan-1-ol
- IUPAC
- 2-(hydroxymethyl)-1-phenylcyclohexan-1-ol
Names & synonyms
NSC28947724927-50-22-(hydroxymethyl)-1-phenylcyclohexan-1-olSCHEMBL898941DTXSID10314867NSC-289477
Database identifiers
- CAS
24927-50-2- PubChem CID
- 324334
- DTXSID
DTXSID10314867
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
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Compound notes
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