6-Chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylic acid
Basic information
- CAS
724749-33-1- Standard SMILES
O=C(O)c1cc(-c2cccc(O)c2)nc2ccc(Cl)cc12- InChIKey
ZNQXAJKEJJLIIX-UHFFFAOYSA-N- Molecular formula
- C16H10ClNO3
- Average molar mass
- 299.71 g/mol
- Monoisotopic mass
- 299.0349209
Names & identifiers
- Preferred name
- 6-Chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylic acid
- IUPAC
- 6-chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylic acid
- English name
- 6-Chloro-2-(3-hydroxy-phenyl)-quinoline-4-carboxylic acid
- Molecular formula
- C16H10ClNO3
- Molecular weight
- 299.71
Names & synonyms
6-chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylic acid724749-33-1MFCD034219354-quinolinecarboxylic acid, 6-chloro-2-(3-hydroxyphenyl)-DTXSID20395980ALBB-011563BBL017423STK446844AKOS003321188SB68691VS-06147DB-027982
Show more names
CHEMBRDG-BB 3013480ART-CHEM-BB B0134806-chloro-2-(3-hydroxyphenyl)cinchoninic acid6-chloro-2-(3-hydroxyphenyl)-4-quinolinecarboxylic acid6-Chloro-2-(3-hydroxy-phenyl)-quinoline-4-carboxylic acid6-chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylic acid(SALTDATA: FREE)
ST50849369H26548F3074706-chloro-2-(3-hydroxyphenyl)quinoline-4-carboxylicacid
Database identifiers
- CAS
724749-33-1- PubChem CID
- 3755294
- DTXSID
DTXSID20395980
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 392
Physicochemical properties
- Boiling point
- 554 · 554.0±50.0 °C(Predicted)
- Density
- 1.462 · 1.462±0.06 g/cm3(Predicted)
- pka
- 0.76 · 0.76±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
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_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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