7-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylic acid
Basic information
- CAS
6338-16-5- Standard SMILES
O=C(O)c1cc(-c2ccc(Cl)cc2)nc2cc(Cl)ccc12- InChIKey
VZUQNWWKOLPWLT-UHFFFAOYSA-N- Molecular formula
- C16H9Cl2NO2
- Average molar mass
- 318.2 g/mol
- Monoisotopic mass
- 317.0010339
Names & identifiers
- Preferred name
- 7-Chloro-2-(4-chlorophenyl)quinoline-4-carboxylic acid
- IUPAC
- 7-chloro-2-(4-chlorophenyl)quinoline-4-carboxylic acid
Names & synonyms
7-chloro-2-(4-chlorophenyl)quinoline-4-carboxylic acid6338-16-5DTXSID60285073RefChem:310555DTXCID802362244-Quinolinecarboxylicacid, 7-chloro-2-(4-chlorophenyl)-NSC40402NSC-40402AKOS012770029
Database identifiers
- CAS
6338-16-5- PubChem CID
- 237134
- DTXSID
DTXSID60285073
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 384
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Compound notes
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