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Product Overview

Product Code

TRC-F322512

CAS Number

1286458-00-1

Product Format

Neat

Molecular Formula

C33H35D6NO4

Molecular Weight

521.72

Product Categories

TRC, Impurity Reference Materials , Stable isotopes

Product Type

Impurity, Stable Isotope Labelled, Bioactive Small Molecule

Unlabelled CAS Number

154825-96-4

Documentation

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Product Information

Chemical Data

Analyte Name

Fexofenadine-d6 Methyl Ester

CAS Number

1286458-00-1

Molecular Formula

C33H35D6NO4

Molecular Weight

521.72

SMILES

OC(CCCN1CCC(C(O)(C2=CC=CC=C2)C3=CC=CC=C3)CC1)C4=CC=C(C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C(OC)=O)C=C4

InChI

InChI=1S/C33H41NO4/c1-32(2,31(36)38-3)26-18-16-25(17-19-26)30(35)15-10-22-34-23-20-29(21-24-34)33(37,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,35,37H,10,15,20-24H2,1-3H3/i1D3,2D3

Unlabelled CAS Number

154825-96-4

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Impurity Type

Intermediate

Product Description

A novel labelled intermediate of Fexofenadine (F322470).

References: McTavish, D., et al.: Drugs, 39, 552

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