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Glafenic acid

HCID 160940
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
10440-42-3
Standard SMILES
O=C(O)c1ccccc1Nc1ccnc2cc(Cl)ccc12
InChIKey
HTKGKUISLUERQX-UHFFFAOYSA-N
Molecular formula
C16H11ClN2O2
Average molar mass
298.729 g/mol
Monoisotopic mass
298.05090527

Names & identifiers

Preferred name
Glafenic acid
IUPAC
2-[(7-Chloroquinolin-4-yl)amino]benzoic acid
English name
glafenic acid
Molecular formula
C16H11ClN2O2
Molecular weight
298.72

Names & synonyms

R 1264glafenic acidN-(7-Chloro-4-quinolyl)anthranilic Acid2-[(7-Chloro-4-quinolinyl)amino]benzoic acid2-((7-Chloroquinolin-4-yl)amino)benzoic acidBenzoic acid, 2-[(7-chloro-4-quinolinyl)amino]-

Database identifiers

CAS
10440-42-3
PubChem CID
160940
DTXSID
DTXSID50146462
Nikkaji
J291.241D

Properties

Physicochemical properties

Melting point
305 · 305-306 °C
Boiling point
486.8 · 486.8±40.0 °C(Predicted)
Density
1.441 · 1.441±0.06 g/cm3(Predicted)
pka
3.46 · 3.46±0.36(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-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
P280-P305+P351+P338

Chemistry & industry

Applications

UsesGlafenic Acid is a major metabolite of Glafenine (G406500).

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Related reactions

2 records
New reaction record
HRID 1217556 reaction equation
HRID 1217556As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 2343204 reaction equation
HRID 2343204As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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