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Product Overview

Product Code

TRC-A791740

CAS Number

134395-00-9

Product Format

Neat

Molecular Formula

C37 H43 F N2 O5

Molecular Weight

614.75

API Family

Atorvastatin Calcium

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

Atorvastatin tert-Butyl Ester

CAS Number

134395-00-9

Molecular Formula

C37 H43 F N2 O5

Molecular Weight

614.75

Accurate Mass

614.3156

SMILES

CC(C)c1c(C(=O)Nc2ccccc2)c(c3ccccc3)c(c4ccc(F)cc4)n1CC[C@@H](O)C[C@@H](O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C37H43FN2O5/c1-24(2)34-33(36(44)39-28-14-10-7-11-15-28)32(25-12-8-6-9-13-25)35(26-16-18-27(38)19-17-26)40(34)21-20-29(41)22-30(42)23-31(43)45-37(3,4)5/h6-19,24,29-30,41-42H,20-23H2,1-5H3,(H,39,44)/t29-,30-/m1/s1

IUPAC

tert-butyl (3R,5R)-7-[2-(4-fluorophenyl)-3-phenyl-4-(phenylcarbamoyl)-5-propan-2-ylpyrrol-1-yl]-3,5-dihydroxyheptanoate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Atorvastatin Calcium

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Product Overview

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Chemical Data

Product Data

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(bR,deltaR)-Atorvastatin tert-Butyl Ester (>90%)

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