Basic information
- Standard SMILES
COc1cc([N+](=O)[O-])ccc1-n1cccc(Br)c1=O- InChIKey
BPWPWQPUIWSWIQ-UHFFFAOYSA-N- Molecular formula
- C12H9BrN2O4
- Average molar mass
- 325.11 g/mol
Names & identifiers
- Preferred name
- 3-Bromo-1-(2-methoxy-4-nitrophenyl)pyridin-2(1H)-one
- IUPAC
- 3-bromo-1-(2-methoxy-4-nitrophenyl)pyridin-2-one
Names & synonyms
SCHEMBL2477846BPWPWQPUIWSWIQ-UHFFFAOYSA-N3-Bromo-1-(2-methoxy-4-nitrophenyl)pyridin-2(1H)-one
Database identifiers
- PubChem CID
- 59410145
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 444
Related reactions
10 records
Compound notes
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