2-((2,3-Dichlorophenyl)amino)benzoic acid

HCID 71194

Basic information

CAS
4295-55-0
Standard SMILES
O=C(O)c1ccccc1Nc1cccc(Cl)c1Cl
InChIKey
JONFYSWOLCTYFK-UHFFFAOYSA-N
Molecular formula
C13H9Cl2NO2
Average molar mass
282.12 g/mol
Monoisotopic mass
281.00103389

Overview

Clofenamic acid is a small molecule drug. Clofenamic acid has a monoisotopic molecular weight of 281.0 Da.

Names & identifiers

Preferred name
2-((2,3-Dichlorophenyl)amino)benzoic acid
IUPAC
2-(2,3-dichloroanilino)benzoic acid
English name
Clofenamic acid
Molecular formula
C13H9Cl2NO2
Molecular weight
282.12

Names & synonyms

Clofenamic acid4295-55-0Acido clofenamicoAcide clofenamiqueAcidum clofenamicum2-[(2,3-dichlorophenyl)amino]benzoic acid1X0MUE4C19N-(2,3-Dichlorphenyl)anthranilsaeureDTXSID901955752-((2,3-Dichlorophenyl)amino)benzoic acidRefChem:1060463DTXCID30118066
Show more names
ClofenamicACIDUMCLOFENAMICChlofenamic acidFlumiclorac-pentyl Impurity 9N-2,3-dichlorophenylanthranilic acidBenzoic acid, 2-[(2,3-dichlorophenyl)amino]-CLOFENAMIC ACID (BP) [N-(2,3-DICHLOROPHENYL)ANTHRANILIC ACID]
224-301-32-(2,3-dichloroanilino)benzoic acidClofenamic acid [INN]N-(2,3-Dichlorophenyl)anthranilic acidClofenaminsaeureUNII-1X0MUE4C19Acide clofenamique [INN-French]Acido clofenamico [INN-Spanish]

Database identifiers

CAS
4295-55-0
PubChem CID
71194
DTXSID
DTXSID90195575
ChEMBL
CHEMBL23115
UNII
1X0MUE4C19
EC Number
224-301-3
Nikkaji
J205.689E

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
49.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
18

Physicochemical properties

Melting point
256 · 256-257 °C
Boiling point
407.1 · 407.1±45.0 °C(Predicted)
Density
1.47 · 1.470±0.06 g/cm3(Predicted)
pka
3.61 · 3.61±0.36(Predicted)
FDA UNII
1 X0MUE4C19 · 1X0MUE4C19
Symbol(GHS)
7 · GHS07

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P203, P264, P270, P273, P280, P301+P316, P318, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 3 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers9 total

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
天津研楷科技有限公司18500985499
北京科易通达科技发展有限公司17743531240 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]

Related reactions

0 records

No reaction records under the current filter.

Compound notes

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