Basic information
- Standard SMILES
COC(=O)c1ccc(-c2cccc(C(C)=O)c2)cc1- InChIKey
DSPHMNWTFHEVRG-UHFFFAOYSA-N- Molecular formula
- C16H14O3
- Average molar mass
- 254.28 g/mol
Names & identifiers
- Preferred name
- 4-Carbomethoxy-3'-Acetylbiphenyl
- IUPAC
- methyl 4-(3-acetylphenyl)benzoate
Names & synonyms
SCHEMBL44332394-Carbomethoxy-3'-AcetylbiphenylDSPHMNWTFHEVRG-UHFFFAOYSA-NAKOS004113998
Database identifiers
- PubChem CID
- 4328804
- Nikkaji
- J1.207.774B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 329
Related reactions
8 records
Compound notes
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