| Identification | Back Directory | [Name]
Celecoxib Impurity | [CAS]
170570-09-9 | [Synonyms]
Celecoxib-14
Celecoxib-003
Celecoxib Impurity
Celecoxib 2,4-Dimethyl
4-(5-(2,4-dimethylphenyl)
Celecoxib Impurity C: 2,3-dimethylcelecoxib
Celecoxib Impurity 7 (2,4 Dimethyl celecoxib)
4-[5-(2,4-Dimethyl-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-...
Benzenesulfonamide,4-[5-(2,4-dimethylphenyl)-3-(trifluoromet...
4-[5-(2,4-Dimethyl-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-benzenesulfonamide
4-(5-(2,4-dimethylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide
Benzenesulfonamide, 4-[5-(2,4-dimethylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]- | [Molecular Formula]
C18H16F3N3O2S | [MDL Number]
MFCD28954796 | [MOL File]
170570-09-9.mol | [Molecular Weight]
395.4 |
| Chemical Properties | Back Directory | [Boiling point ]
521.9±60.0 °C(Predicted) | [density ]
1.40±0.1 g/cm3(Predicted) | [solubility ]
Chloroform (Slightly), Methanol (Slightly) | [form ]
Solid | [pka]
9.68±0.10(Predicted) | [color ]
Off-White to Pale Beige | [InChI]
InChI=1S/C18H16F3N3O2S/c1-11-3-8-15(12(2)9-11)16-10-17(18(19,20)21)23-24(16)13-4-6-14(7-5-13)27(22,25)26/h3-10H,1-2H3,(H2,22,25,26) | [InChIKey]
CDMHSMOZNZFYIK-UHFFFAOYSA-N | [SMILES]
C1(S(N)(=O)=O)=CC=C(N2C(C3=CC=C(C)C=C3C)=CC(C(F)(F)F)=N2)C=C1 |
| Hazard Information | Back Directory | [Uses]
2-Methyl-Celecoxib is an analog of the anti-inflammatory drug Celecoxib (C251000). Celecoxib is a selective cyclooxygenase-2 (COX-2) inhibitor. |
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