Basic information
- CAS
153951-96-3- Standard SMILES
Cc1cc2c(=O)cc(C(=O)O)[nH]c2cc1Cl- InChIKey
ZDPZMPRVICWFEP-UHFFFAOYSA-N- Molecular formula
- C11H8ClNO3
- Average molar mass
- 237.64 g/mol
- Monoisotopic mass
- 237.0192708
Names & identifiers
- Preferred name
- 7-Chloro-4-hydroxy-6-methyl-2-quinolinecarboxylic acid
- IUPAC
- 7-chloro-6-methyl-4-oxo-1H-quinoline-2-carboxylic acid
Names & synonyms
153951-96-3SCHEMBL29069667-Chloro-4-hydroxy-6-methyl-2-quinolinecarboxylic acidDTXSID5012102997-Chloro-4-hydroxy-6-methylquinoline-2-carboxylic acid
Database identifiers
- CAS
153951-96-3- PubChem CID
- 22017490
- DTXSID
DTXSID501210299
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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