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Product Overview

Product Code

TRC-D322500

CAS Number

161599-46-8

USP Description

Capecitabine Diacetyl Amino Impurity (USP)

Product Format

Neat

Molecular Formula

C13 H16 F N3 O6

Molecular Weight

329.28

API Family

Capecitabine

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

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Product Information

Chemical Data

Analyte Name

2',3'-Di-O-acetyl-5'-deoxy-5-fluorocytidine

CAS Number

161599-46-8

Molecular Formula

C13 H16 F N3 O6

Molecular Weight

329.28

Accurate Mass

329.1023

SMILES

C[C@H]1O[C@H]([C@H](OC(=O)C)[C@@H]1OC(=O)C)N2C=C(F)C(=NC2=O)N

InChI

InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10-,12-/m1/s1

IUPAC

[(2R,3R,4R,5R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Capecitabine

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Product Overview

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Chemical Data

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2’,3’-Di-O-acetyl-5’-deoxy-5-fluorocytidine

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