7-Chloro-2-phenylquinoline-4-carboxylic acid
Basic information
- CAS
5439-80-5- Standard SMILES
O=C(O)c1cc(-c2ccccc2)nc2cc(Cl)ccc12- InChIKey
UBGLAVCSQCRIHC-UHFFFAOYSA-N- Molecular formula
- C16H10ClNO2
- Average molar mass
- 283.71 g/mol
- Monoisotopic mass
- 283.0400063
Names & identifiers
- Preferred name
- 7-Chloro-2-phenylquinoline-4-carboxylic acid
- IUPAC
- 7-chloro-2-phenylquinoline-4-carboxylic acid
- English name
- 4-QUINOLINECARBOXYLIC ACID,7-CHLORO-2-PHENYL-
- Molecular formula
- C16H10ClNO2
- Molecular weight
- 283.71
Names & synonyms
7-chloro-2-phenylquinoline-4-carboxylic acid5439-80-5DTXSID20280064RefChem:310580DTXCID202312187-chloro-2-phenyl-quinoline-4-carboxylic acidMFCD04035486NSC15288SCHEMBL1901263CHEMBL2263039NSC-15288STL480751
Show more names
4-QUINOLINECARBOXYLIC ACID,7-CHLORO-2-PHENYL-
AKOS012772411SB69370SY2670167-chloro-2-phenylquinoline-4-carboxylicacidDS-005978Z1136697556
Database identifiers
- CAS
5439-80-5- PubChem CID
- 225673
- DTXSID
DTXSID20280064- ChEMBL
CHEMBL2263039- Nikkaji
- J2.580.141E
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 356
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…