4-Bromo-7-nitroquinoline-3-carboxylic acid
Basic information
- CAS
1378260-40-2- Standard SMILES
O=C(O)c1cnc2cc([N+](=O)[O-])ccc2c1Br- InChIKey
RNEURQURSCOFRL-UHFFFAOYSA-N- Molecular formula
- C10H5BrN2O4
- Average molar mass
- 297.06 g/mol
- Monoisotopic mass
- 295.94327
Names & identifiers
- Preferred name
- 4-Bromo-7-nitroquinoline-3-carboxylic acid
- IUPAC
- 4-bromo-7-nitroquinoline-3-carboxylic acid
Names & synonyms
4-Bromo-7-nitroquinoline-3-carboxylic acid1378260-40-24-Bromo-7-nitro-quinoline-3-carboxylic acidDTXSID401257660SB710854-Bromo-7-nitroquinoline-3-carboxylicacid3-Quinolinecarboxylic acid, 4-bromo-7-nitro-
Database identifiers
- CAS
1378260-40-2- PubChem CID
- 97033466
- DTXSID
DTXSID401257660
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 96 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 333
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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