Basic information
- Standard SMILES
O=C(O)Cc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]- InChIKey
MXVAMFYSKAUGSC-UHFFFAOYSA-N- Molecular formula
- C15H11NO5
- Average molar mass
- 285.25 g/mol
Names & identifiers
- Preferred name
- 2-Nitro-4-benzoylphenylacetic acid
- IUPAC
- 2-(4-benzoyl-2-nitrophenyl)acetic acid
Names & synonyms
SCHEMBL9387589MXVAMFYSKAUGSC-UHFFFAOYSA-N2-nitro-4-benzoylphenylacetic acid
Database identifiers
- PubChem CID
- 13770536
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 411
Related reactions
6 records
Compound notes
Loading…