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Product Overview

Product Code

TRC-C597485

CAS Number

945553-91-3

Product Format

Neat

Molecular Formula

C24H25ClFN5O3

Molecular Weight

485.94

API Family

Afatinib

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

(R)-Afatinib

CAS Number

945553-91-3

Molecular Formula

C24H25ClFN5O3

Molecular Weight

485.94

Accurate Mass

485.163

SMILES

O=C(NC1=CC2=C(NC3=CC=C(F)C(Cl)=C3)N=CN=C2C=C1O[C@H]4COCC4)/C=C/CN(C)C

InChI

InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m1/s1

IUPAC

(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3R)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Afatinib

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