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Product Overview

Product Code

TRC-C327052

CAS Number

65891-81-8

Product Format

Neat

Molecular Formula

C16 2H5 H9 Cl N3 O

Molecular Weight

304.79

API Family

Chlordiazepoxide

Product Type

Impurity, Stable Isotope Labelled

Unlabelled CAS Number

58-25-3

Drug Type

Other Drugs & Biomarkers

Documentation

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Product Information

Chemical Data

Analyte Name

Chlordiazepoxide-D5

CAS Number

65891-81-8

Molecular Formula

C16 2H5 H9 Cl N3 O

Molecular Weight

304.79

Accurate Mass

304.1139

SMILES

[2H]c1c([2H])c([2H])c(C2=[N+]([O-])CC(=Nc3ccc(Cl)cc23)NC)c([2H])c1[2H]

InChI

InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)/i2D,3D,4D,5D,6D

IUPAC

7-chloro-N-methyl-4-oxido-5-(2,3,4,5,6-pentadeuteriophenyl)-3H-1,4-benzodiazepin-4-ium-2-amine

Unlabelled CAS Number

58-25-3

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity; Stable Isotope Labelled

Product Format

Neat

API Family

Chlordiazepoxide

Product Description

Controlled substance (depressant). Anxiolytic. Prototype of the benzodiazepine anxiolytics.

References: MacDonald, A., et al.: Anal. Profiles Drug Subs., 1, 15 (1972), Greenblatt, D.J., et al.: Clin. Pharmacokinet., 3, 381 (1978),

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