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Product Overview

Product Code

TRC-A604205

CAS Number

376608-74-1

Product Format

Neat

Molecular Formula

C17 H27 Cl N4 O4 S

Molecular Weight

418.94

API Family

Ticagrelor

Product Categories

Impurity Reference Materials , TRC

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

2-[((3aR,4S,6R,6aS)-6-[(5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl)amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl)oxy]ethanol

CAS Number

376608-74-1

Molecular Formula

C17 H27 Cl N4 O4 S

Molecular Weight

418.94

Accurate Mass

418.1442

SMILES

CCCSc1nc(Cl)c(N)c(N[C@@H]2C[C@H](OCCO)[C@H]3OC(C)(C)O[C@@H]23)n1

InChI

InChI=1S/C17H27ClN4O4S/c1-4-7-27-16-21-14(18)11(19)15(22-16)20-9-8-10(24-6-5-23)13-12(9)25-17(2,3)26-13/h9-10,12-13,23H,4-8,19H2,1-3H3,(H,20,21,22)/t9-,10+,12+,13-/m1/s1

IUPAC

2-[[(3aR,4S,6R,6aS)-6-[(5-amino-6-chloro-2-propylsulfanylpyrimidin-4-yl)amino]-2,2-dimethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]oxy]ethanol

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

Impurity Type

Intermediate

API Family

Ticagrelor

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Product Overview

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Chemical Data

Product Data

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2-[[(3aR,4S,6R,6aS)-6-[[5-Amino-6-chloro-2-(propylthio)-4-pyrimidinyl]amino]tetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-yl]oxy]ethanol

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