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Product Overview

Product Code

TRC-M515795

CAS Number

851976-50-6

Product Format

Neat

Molecular Formula

C20 H13 F6 N3 O2 S

Molecular Weight

473.39

API Family

Monepantel

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , Pharmaceutical and veterinary compounds and metabolites Reference Materials , Impurity Reference Materials

Product Type

Impurity

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

rac-Monepantel

CAS Number

851976-50-6

Molecular Formula

C20 H13 F6 N3 O2 S

Molecular Weight

473.39

Accurate Mass

473.0633

SMILES

CC(COc1cc(ccc1C(F)(F)F)C#N)(NC(=O)c2ccc(SC(F)(F)F)cc2)C#N

InChI

InChI=1S/C20H13F6N3O2S/c1-18(10-28,11-31-16-8-12(9-27)2-7-15(16)19(21,22)23)29-17(30)13-3-5-14(6-4-13)32-20(24,25)26/h2-8H,11H2,1H3,(H,29,30)

IUPAC

N-[2-cyano-1-[5-cyano-2-(trifluoromethyl)phenoxy]propan-2-yl]-4-(trifluoromethylsulfanyl)benzamide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Monepantel

Purity

>95% (HPLC)

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