Basic information
- Standard SMILES
CC(=O)C(C(=O)c1ccccc1)C(=O)c1ccccc1- InChIKey
GHVVZXRZVGCCNG-UHFFFAOYSA-N- Molecular formula
- C17H14O3
- Average molar mass
- 266.29 g/mol
Names & identifiers
- Preferred name
- 2-Benzoyl-1-phenyl-1,3-butanedione
- IUPAC
- 2-benzoyl-1-phenylbutane-1,3-dione
Names & synonyms
2-benzoyl-1-phenyl-1,3-butanedioneCBMicro_016161acetyldibenzoylmethanAcetyldibenzoylmethaneSCHEMBL2853917GHVVZXRZVGCCNG-UHFFFAOYSA-NCCG-5053AKOS003622844BIM-0016000.P001AE-848/30740020SR-01000196730SR-01000196730-1
Database identifiers
- PubChem CID
- 786313
- Nikkaji
- J583.943B
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 344
Related reactions
2 records
Compound notes
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