Basic information
- Standard SMILES
O=C(C=C1CC(C(=O)O)C1)OCc1ccccc1- InChIKey
VZBHEUFPNGEGKH-UHFFFAOYSA-N- Molecular formula
- C14H14O4
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.08920892
Names & identifiers
- Preferred name
- 3-[2-(Benzyloxy)-2-oxoethylidene]cyclobutane-1-carboxylic acid
- IUPAC
- 3-(2-oxo-2-phenylmethoxyethylidene)cyclobutane-1-carboxylic acid
Names & synonyms
SCHEMBL9106935VZBHEUFPNGEGKH-UHFFFAOYSA-N3-[2-(benzyloxy)-2-oxoethylidene]cyclobutane-1-carboxylic acid
Database identifiers
- PubChem CID
- 67775344
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 345
Related reactions
4 records
Compound notes
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