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

Safety Information

HS Code 

2933194350

Celecoxib Impurity Usage And Synthesis

Uses

2-Methyl-Celecoxib is an analog of the anti-inflammatory drug Celecoxib (C251000). Celecoxib is a selective cyclooxygenase-2 (COX-2) inhibitor.

Uses

Celecoxib Impurity is also called 2-Methyl-Celecoxib, which is an impurity of the drug Celecoxib. It can be used as an impurity reference for testing the quality of drugs, and is often used in pharmaceutical production.

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