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Product Overview

Product Code

TRC-C175660

CAS Number

921769-65-5

EP Description

Capecitabine EP Impurity F

USP Description

USP Capecitabine Related Compound C

Product Format

Neat

Molecular Formula

C16 H20 F N3 O7

Molecular Weight

385.34

API Family

Capecitabine

Product Categories

Impurity Reference Materials , TRC, Oligosaccharides, Carbohydrates, Pyrimidines, Nucleobase, nucleoside & nucleotide derivatives, Nucleotides & nucleosides, Nucleotides and nucleosides

Product Type

Impurity, Bioactive Small Molecule

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

2',3'-O-Carbonyl-5'-deoxy-5-fluoro-N4-(pentyloxycarbonyl)cytidine

CAS Number

921769-65-5

Molecular Formula

C16 H20 F N3 O7

Molecular Weight

385.34

Accurate Mass

385.1285

SMILES

CCCCCOC(=O)NC1=NC(=O)N(C=C1F)[C@@H]2O[C@H](C)[C@H]3OC(=O)O[C@@H]23

InChI

InChI=1S/C16H20FN3O7/c1-3-4-5-6-24-15(22)19-12-9(17)7-20(14(21)18-12)13-11-10(8(2)25-13)26-16(23)27-11/h7-8,10-11,13H,3-6H2,1-2H3,(H,18,19,21,22)/t8-,10-,11-,13-/m1/s1

IUPAC

pentyl N-[1-[(3aR,4R,6R,6aR)-6-methyl-2-oxo-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]-5-fluoro-2-oxopyrimidin-4-yl]carbamate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Capecitabine

Purity

>95% (HPLC)

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Capecitabine-2',3'-cyclic Carbonate

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