Product Code

TRC-D291817

Product Format

Neat

Molecular Formula

C17 D4 H10 F3 N3 O2 S

Molecular Weight

385.397

Product Categories

Cyclooxygenase, Pain and Inflammation, Stable isotopes, TRC

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

170569-99-0

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

4-Desmethyl-2-methyl Celecoxib-d4

Molecular Formula

C17 D4 H10 F3 N3 O2 S

Molecular Weight

385.397

Accurate Mass

385.101

SMILES

[2H]c1c([2H])c(c([2H])c([2H])c1n2nc(cc2c3ccccc3C)C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C17H14F3N3O2S/c1-11-4-2-3-5-14(11)15-10-16(17(18,19)20)22-23(15)12-6-8-13(9-7-12)26(21,24)25/h2-10H,1H3,(H2,21,24,25)/i6D,7D,8D,9D

IUPAC

2,3,5,6-tetradeuterio-4-[5-(2-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Unlabelled CAS Number

170569-99-0

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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4-Desmethyl-2-methyl Celecoxib-d4

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