Description:
An impurity of Celecoxib, a cyclooxygenase 2 inhibitor.
- Molecular Weight: 226.2
- Molecular Formula: C11H9F3N2
Purity: 95%
Canonical SMILES:
CC1=CC=C(C=C1)C2=NNC(=C2)C(F)(F)F
InChI:
InChI=1S/C11H9F3N2/c1-7-2-4-8(5-3-7)9-6-10(16-15-9)11(12,13)14/h2-6H,1H3,(H,15,16)
InChIKey: NQEFIPVOJGJVRG-UHFFFAOYSA-N
- Boiling Point: 344.2 °C at 760 mmHg
- Melting Point: 167-169 °C
- Appearance: Solid
- Storage: -20 °C
Synonyms:
3-(4-methylphenyl)-5-(trifluoromethyl)pyrazole; 3-(Trifluoromethyl)-5-p-tolyl-1H-pyrazole; 3-(p-Tolyl)-5-(trifluoromethyl)-1H-pyrazole
More details are to be found on supplier website
