5-((2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl)sulfonamido)-4H-1,2,4-triazole-3-carboxylic Acid

Analyte Name

5-((2-(2,2-Difluoroethoxy)-6-(trifluoromethyl)phenyl)sulfonamido)-4H-1,2,4-triazole-3-carboxylic Acid

CAS Number

907215-84-3

Molecular Formula

C12 H9 F5 N4 O5 S

Molecular Weight

416.28

Accurate Mass

416.0214

SMILES

OC(=O)c1nnc(NS(=O)(=O)c2c(OCC(F)F)cccc2C(F)(F)F)[nH]1

InChI

InChI=1S/C12H9F5N4O5S/c13-7(14)4-26-6-3-1-2-5(12(15,16)17)8(6)27(24,25)21-11-18-9(10(22)23)19-20-11/h1-3,7H,4H2,(H,22,23)(H2,18,19,20,21)

IUPAC

5-[[2-(2,2-difluoroethoxy)-6-(trifluoromethyl)phenyl]sulfonylamino]-4H-1,2,4-triazole-3-carboxylic acid

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)