Basic information
- Standard SMILES
OCC(CO)(COCc1ccccc1)C1CCCCC1- InChIKey
NLRSMIZDLOSUPL-UHFFFAOYSA-N- Molecular formula
- C17H26O3
- Average molar mass
- 278.4 g/mol
Names & identifiers
- Preferred name
- 2-Benzyloxymethyl-2-cyclohexylpropan-1,3-diol
- IUPAC
- 2-cyclohexyl-2-(phenylmethoxymethyl)propane-1,3-diol
Names & synonyms
SCHEMBL9261066NLRSMIZDLOSUPL-UHFFFAOYSA-N2-Benzyloxymethyl-2-cyclohexylpropan-1,3-diol2-Benzyloxymethyl-2-cyclohexyl-propan-1,3-diol
Database identifiers
- PubChem CID
- 19373373
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 251
Related reactions
8 records
Compound notes
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