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Product Overview

Product Code

TRC-P180310

CAS Number

1803108-03-3

Product Format

Neat

Molecular Formula

C21 H22 Cl F2 N5 O2

Molecular Weight

449.88

Product Type

Contaminant

Product Information

Chemical Data

Analyte Name

Pyrapropoyne

CAS Number

1803108-03-3

Molecular Formula

C21 H22 Cl F2 N5 O2

Molecular Weight

449.88

Accurate Mass

449.143

SMILES

CC(C)O\N=C(\CNC(=O)c1cn(C)nc1C(F)F)/c2ncc(cc2Cl)C#CC3CC3

InChI

InChI=1S/C21H22ClF2N5O2/c1-12(2)31-28-17(10-26-21(30)15-11-29(3)27-18(15)20(23)24)19-16(22)8-14(9-25-19)7-6-13-4-5-13/h8-9,11-13,20H,4-5,10H2,1-3H3,(H,26,30)/b28-17-

IUPAC

N-[(2Z)-2-[3-chloro-5-(2-cyclopropylethynyl)-2-pyridyl]-2-isopropoxyimino-ethyl]-3-(difluoromethyl)-1-methyl-pyrazole-4-carboxamide

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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