4(1H)-Quinolinone, 7-bromo-2,3-dihydro-2-(4-nitrophenyl)-
Basic information
- CAS
882854-44-6- Standard SMILES
O=C1CC(c2ccc([N+](=O)[O-])cc2)Nc2cc(Br)ccc21- InChIKey
MQEBXLMQNILUQN-UHFFFAOYSA-N- Molecular formula
- C15H11BrN2O3
- Average molar mass
- 347.16 g/mol
- Monoisotopic mass
- 345.9953
Names & identifiers
- Preferred name
- 4(1H)-Quinolinone, 7-bromo-2,3-dihydro-2-(4-nitrophenyl)-
- IUPAC
- 7-bromo-2-(4-nitrophenyl)-2,3-dihydro-1H-quinolin-4-one
Names & synonyms
882854-44-67-Bromo-2-(4-nitrophenyl)-2,3-dihydroquinolin-4(1H)-one4(1H)-Quinolinone, 7-bromo-2,3-dihydro-2-(4-nitrophenyl)-DTXSID10470210
Database identifiers
- CAS
882854-44-6- PubChem CID
- 11660254
- DTXSID
DTXSID10470210- Nikkaji
- J2.294.324C
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 418
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Compound notes
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