Celecoxib Impurity

Chemical Properties

Boiling point	521.9±60.0 °C(Predicted)
Density	1.40±0.1 g/cm3(Predicted)
solubility	Chloroform (Slightly), Methanol (Slightly)
pka	9.68±0.10(Predicted)
form	Solid
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

HS Code

2933194350