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Product Overview

Product Code

TRC-D198955

CAS Number

67914-61-8

EP Description

Ketoconazole EP Impurity D

Product Format

Neat

Molecular Formula

C24 H26 Cl2 N4 O3

Molecular Weight

489.39

API Family

Ketoconazole

Product Categories

TRC, Impurity Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Impurity

Alternate CAS Number

Relative stereochemistry: 1100930-35-5

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Deacetyl Ketoconazole

CAS Number

67914-61-8

Molecular Formula

C24 H26 Cl2 N4 O3

Molecular Weight

489.39

Accurate Mass

488.1382

SMILES

Clc1ccc(c(Cl)c1)[C@@]2(Cn3ccnc3)OC[C@H](COc4ccc(cc4)N5CCNCC5)O2

InChI

InChI=1S/C24H26Cl2N4O3/c25-18-1-6-22(23(26)13-18)24(16-29-10-7-28-17-29)32-15-21(33-24)14-31-20-4-2-19(3-5-20)30-11-8-27-9-12-30/h1-7,10,13,17,21,27H,8-9,11-12,14-16H2/t21-,24-/m0/s1

IUPAC

1-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazine

Alternate CAS Number

Relative stereochemistry: 1100930-35-5

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Ketoconazole

Purity

>95% (HPLC)

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