Basic information
- CAS
13278-36-9- Standard SMILES
O=C(O)c1ccccc1Nc1cccc(Cl)c1- InChIKey
OVMWPVYEBVFZHM-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO2
- Average molar mass
- 247.67 g/mol
- Monoisotopic mass
- 247.04000624
Names & identifiers
- Preferred name
- 2-((3-Chlorophenyl)amino)benzoic acid
- IUPAC
- 2-(3-chloroanilino)benzoic acid
- English name
- Clofenamic acid
- Molecular formula
- C13H10ClNO2
- Molecular weight
- 247.68
Names & synonyms
13278-36-92-((3-Chlorophenyl)amino)benzoic acid2-[(3-Chlorophenyl)amino]benzoic AcidBenzoic acid, 2-[(3-chlorophenyl)amino]-Benzoic acid, 2-((3-chlorophenyl)amino)-LW9LF7L96XN-(m-Chlorophenyl)anthranilic acidNSC-49135DTXSID70157792RefChem:1060506DTXCID1080283603-657-7
Show more names
LvfnashkopxClofemic acidChlorine acidClofenamic acidChlorfenamic Acid2-((3-Chlorophenyl)Clofenamic acid USP/EP/BPo-(m-Chloroanilino)benzoic acid
2-(3-Chloroanilino)benzoic acidN-(3-Chlorophenyl)anthranilic AcidMFCD01928172CHEMBL22815Chlorpromazine Impurity 7NSC49135NSC 49135UNII-LW9LF7L96X
Database identifiers
- CAS
13278-36-9- PubChem CID
- 83293
- DTXSID
DTXSID70157792- ChEMBL
CHEMBL22815- UNII
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Melting point
- 171 °C · 171 °C
- Boiling point
- 403.7 · 403.7±30.0 °C(Predicted)
- Density
- 1.376 · 1.376±0.06 g/cm3(Predicted)
- solubility
- soluble in Methanol
- form
- powder to crystal
- pka
- 3.66 · 3.66±0.36(Predicted)
- color
- Light yellow to Amber to Dark green
- CAS DataBase Reference
- 13278 · 13278-36-9(CAS DataBase Reference)
- FDA UNII
- 9 LF7L96X · LW9LF7L96X
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2922.49 · 2922.49.3700
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
- hs_code
- 2922.49.3700
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesClofenamic acid is a nonsteroidal anti-inflammatory drug (NSAID) with anti-inflammatory, antipyretic, and analgesic effects, used to treat rheumatoid arthritis and rheumatoid arthritis. It is also an intermediate in the production of chlorpromazine.
Upstream & downstream products
Upstream raw materials
Suppliers58 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
Related reactions
2 records
Compound notes
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