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Product Overview

Product Code

TRC-C280502

CAS Number

1998128-85-0

Product Format

Neat

Molecular Formula

C25 H39 D7 N . Cl

Molecular Weight

403.14

Product Categories

Ammonium salts, Titration reagents, Fungicides and metabolites, Titration reagents, Titration reagents, Other antifungals, Cationic detergents, Stains & dyes, Fungicides and metabolites, Stable isotopes, Stable Isotope Labelled Analytical Standards, TRC, Pharmaceutical Toxicology Reference Materials , Pesticide & Metabolite Reference Materials and Research Chemicals

Product Type

Stable Isotope Labelled, Contaminant

Unlabelled CAS Number

122-18-9

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

Cetalkonium Chloride-d7

CAS Number

1998128-85-0

Molecular Formula

C25 H39 D7 N . Cl

Molecular Weight

403.14

Accurate Mass

402.38

SMILES

C([N+](CCCCCCCCCCCCCCCC)(C)C)(C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H])([2H])[2H].[Cl-]

InChI

InChI=1S/C25H46N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25;/h17-19,21-22H,4-16,20,23-24H2,1-3H3;1H/q+1;/p-1/i17D,18D,19D,21D,22D,24D2;

IUPAC

N,N-dimethyl-N-((phenyl-d5)methyl-d2)hexadecan-1-aminium chloride

Unlabelled CAS Number

122-18-9

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

Purity

>95% (HPLC)

Product Description

Labelled Cetalkonium Chloride. Cationic quaternary ammonium surfactant germicide and fungicide. Used in leather processing, textile dyeing. A mildew preventive in silicone-based water repellents. Compatible with many nonionic detergents. Active in moderately alkaline solutions. Anti-infective (topical).

References: Colbeau, A., et al.: J. Bacteriol., 144, 141 (1980),

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