Cliprofen
Basic information
- CAS
51022-75-4- Standard SMILES
CC(C(=O)O)c1ccc(C(=O)c2cccs2)c(Cl)c1- InChIKey
NLGUJWNOGYWZBI-UHFFFAOYSA-N- Molecular formula
- C14H11ClO3S
- Average molar mass
- 294.8 g/mol
- Monoisotopic mass
- 294.0117431
Names & identifiers
- Preferred name
- Cliprofen
- IUPAC
- 2-[3-chloro-4-(thiophene-2-carbonyl)phenyl]propanoic acid
- English name
- Cliprofen
- Molecular formula
- C14H11ClO3S
- Molecular weight
- 294.75
Names & synonyms
Cliprofen51022-75-4Cliprofeno2-[3-chloro-4-(thiophene-2-carbonyl)phenyl]propanoic acidBB27ZR25WO3-Chloro-4-(2-thenoyl)hydratropic acidR-25160R-25,1603-Chloro-alpha-methyl-4-(2-thienylcarbonyl)benzeneacetic acidCliprofenumCliprofen [USAN:INN]UNII-BB27ZR25WO
Show more names
Benzeneacetic acid, 3-chloro-α-methyl-4-(2-thienylcarbonyl)-
CliprofeneCLIPROFEN [INN]Cliprofen (USAN/INN)CLIPROFEN [USAN]2-(3-Chlor-4-(2-thenoyl)phenyl)propionsaeureR 25160SCHEMBL42298CHEMBL2104170
Database identifiers
- CAS
51022-75-4- PubChem CID
- 167449
- DTXSID
DTXSID10866174- ChEMBL
CHEMBL2104170- UNII
- BB27ZR25WO
- Nikkaji
- J10.283K
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 82.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 361
Physicochemical properties
- Melting point
- 82.5 °C · 82.5 °C
- Boiling point
- 466.2 · 466.2±40.0 °C(Predicted)
- Density
- 1.379 · 1.379±0.06 g/cm3(Predicted)
- pka
- 3.9 · 3.90±0.10(Predicted)
- FDA UNII
- 27 ZR25WO · BB27ZR25WO
Chemistry & industry
Applications
UsesAnti-inflammatory.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
3 records
Compound notes
Loading…