Basic information
- Standard SMILES
O=C(O)CC1(CC(=O)OCc2ccccc2)CCCCC1- InChIKey
OCELUFNUGQUCPU-UHFFFAOYSA-N- Molecular formula
- C17H22O4
- Average molar mass
- 290.4 g/mol
Names & identifiers
- Preferred name
- (1-Benzyloxycarbonylmethyl-cyclohexyl)-acetic acid
- IUPAC
- 2-[1-(2-oxo-2-phenylmethoxyethyl)cyclohexyl]acetic acid
Names & synonyms
113009-25-9SCHEMBL394093OCELUFNUGQUCPU-UHFFFAOYSA-NDS-019451(1-Benzyloxycarbonylmethyl-cyclohexyl)-acetic acid
Database identifiers
- PubChem CID
- 14036669
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 352
Related reactions
8 records
Compound notes
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