Basic information
- Standard SMILES
O=C(c1ccc(F)cc1)C(Br)Cc1ccc([N+](=O)[O-])cc1- InChIKey
IZOOPSVUDCCCAO-UHFFFAOYSA-N- Molecular formula
- C15H11BrFNO3
- Average molar mass
- 352.15 g/mol
Names & identifiers
- Preferred name
- 2-Bromo-1-(4-fluoro-phenyl)-3-(4-nitro-phenyl)-propan-1-one
- IUPAC
- 2-bromo-1-(4-fluorophenyl)-3-(4-nitrophenyl)propan-1-one
Names & synonyms
SCHEMBL1304165IZOOPSVUDCCCAO-UHFFFAOYSA-N2-bromo-1-(4-fluoro-phenyl)-3-(4-nitro-phenyl)-propan-1-one
Database identifiers
- PubChem CID
- 86636626
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 372
Related reactions
3 records
Compound notes
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