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HomeProduct name listCelecoxib Impurity

Celecoxib Impurity

  • CAS NO.:170570-09-9
  • Empirical Formula: C18H16F3N3O2S
  • Molecular Weight: 395.4
  • MDL number: MFCD28954796
  • Update Date: 2023-09-07 10:06:18
Celecoxib Impurity Structural

What is Celecoxib Impurity?

The Uses of Celecoxib Impurity

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

The Uses of Celecoxib Impurity

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.

Properties of Celecoxib Impurity

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)

Safety information for Celecoxib Impurity

Computed Descriptors for Celecoxib Impurity

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

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