Basic information
- Standard SMILES
C=CCc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1- InChIKey
OWJZFOYOCZPNQX-UHFFFAOYSA-N- Molecular formula
- C16H13NO3
- Average molar mass
- 267.28 g/mol
Names & identifiers
- Preferred name
- 2-Allyl-5-nitrobenzophenone
- IUPAC
- (5-nitro-2-prop-2-enylphenyl)-phenylmethanone
Names & synonyms
2-allyl-5-nitrobenzophenoneSCHEMBL7076044OWJZFOYOCZPNQX-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 9816801
- Nikkaji
- J1.799.026H
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 368
Related reactions
1 records
Compound notes
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