Basic information
- Standard SMILES
COc1ccc(C(=O)c2ccc(-c3ccccc3)cc2)c(C(=O)O)c1- InChIKey
ZHMAPGBAEIOEED-UHFFFAOYSA-N- Molecular formula
- C21H16O4
- Average molar mass
- 332.3 g/mol
- Monoisotopic mass
- 332.10485899
Names & identifiers
- Preferred name
- 2-(Biphenyl-4-carbonyl)-5-methoxybenzoic acid
- IUPAC
- 5-methoxy-2-(4-phenylbenzoyl)benzoic acid
Names & synonyms
SCHEMBL4833882ZHMAPGBAEIOEED-UHFFFAOYSA-N2-(biphenyl-4-carbonyl)-5-methoxybenzoic acid
Database identifiers
- PubChem CID
- 69209013
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 461
Related reactions
1 records
Compound notes
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