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Product Overview

Product Code

TRC-I937504

Product Format

Neat

Molecular Formula

C35H29D9Cl2N8O4

Molecular Weight

714.69

API Family

Itraconazole

Product Categories

Antimycotics, TRC, Chiral Molecules , Antimycotics, Forensic and Toxicology Reference Materials, API Reference Standards & Research Materials, Antimycotics, Antifungals, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled, API

Unlabelled CAS Number

84625-61-6

Purity

>95% (HPLC)

Drug Type

Antifungals

Documentation

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Product Information

Chemical Data

Analyte Name

Itraconazole-d9

Molecular Formula

C35H29D9Cl2N8O4

Molecular Weight

714.69

SMILES

ClC1=CC(Cl)=CC=C1[C@]2(CN3C=NC=N3)O[C@@H](COC4=CC=C(N5CCN(C6=CC=C(N7C=NN(C([2H])(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])[2H])C7=O)C=C6)CC5)C=C4)CO2

InChI

InChI=1S/C35H38Cl2N8O4/c1-3-25(2)45-34(46)44(24-40-45)29-7-5-27(6-8-29)41-14-16-42(17-15-41)28-9-11-30(12-10-28)47-19-31-20-48-35(49-31,21-43-23-38-22-39-43)32-13-4-26(36)18-33(32)37/h4-13,18,22-25,31H,3,14-17,19-21H2,1-2H3/t25?,31-,35-/m0/s1/i1D3,2D3,3D2,25D

Unlabelled CAS Number

84625-61-6

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Itraconazole

Purity

>95% (HPLC)

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