Basic information
- Standard SMILES
O=C(C=Cc1ccccc1)c1cccc([N+](=O)[O-])c1- InChIKey
MJXRQBATDWPDNF-UHFFFAOYSA-N- Molecular formula
- C15H11NO3
- Average molar mass
- 253.25 g/mol
- Monoisotopic mass
- 253.07389321
Names & identifiers
- Preferred name
- 1-(3-Nitrophenyl)-3-phenyl-2-propen-1-one
- IUPAC
- 1-(3-nitrophenyl)-3-phenylprop-2-en-1-one
Names & synonyms
1-(3-nitrophenyl)-3-phenyl-2-propen-1-onem-nitrobenzalacetophenoneSCHEMBL9779526MJXRQBATDWPDNF-UHFFFAOYSA-NAKOS024318999ST50409036(2E)-1-(3-nitrophenyl)-3-phenyl-2-propen-1-one
Database identifiers
- PubChem CID
- 302446
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 353
Related reactions
1 records
Compound notes
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