8-Bromo-1,2-dihydro-7-methoxy-2-oxo-3-quinolinecarboxylic acid
Basic information
- CAS
800412-47-9- Standard SMILES
COc1ccc2cc(C(=O)O)c(=O)[nH]c2c1Br- InChIKey
RXVNOOJJPUKZFE-UHFFFAOYSA-N- Molecular formula
- C11H8BrNO4
- Average molar mass
- 298.09 g/mol
- Monoisotopic mass
- 296.96367
Names & identifiers
- Preferred name
- 8-Bromo-1,2-dihydro-7-methoxy-2-oxo-3-quinolinecarboxylic acid
- IUPAC
- 8-bromo-7-methoxy-2-oxo-1H-quinoline-3-carboxylic acid
Names & synonyms
DTXSID2011776248-Bromo-1,2-dihydro-7-methoxy-2-oxo-3-quinolinecarboxylic acid8-Bromo-7-methoxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid800412-47-9
Database identifiers
- CAS
800412-47-9- PubChem CID
- 165352016
- DTXSID
DTXSID201177624
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 382
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Compound notes
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