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Cetylpyridinium Chloride-[d5] Monohydrate

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General Information
Catalog: BLP-000132
Molecular Formula: C21H35D5ClNO
Molecular Weight: 363.03

Chemical Structure

Description	Cetylpyridinium Chloride-[d5] Monohydrate, is the labelled analogue of Cetylpyridinium Chloride Monohydrate, Cetylpyridinium Chloride Monohydrate is a broad antimicrobial spectrum with a rapid bactericidal effect on gram-positive pathogens and a fungicide effect on yeasts used as an oropharyngeal antiseptic.
Synonyms	Hexadecyl-(pyridinium-d5)-chloride monohydrate; Cetyl(pyridinium-d5) chloride monohydrate
IUPAC Name	2,3,4,5,6-pentadeuterio-1-hexadecylpyridin-1-ium;chloride;hydrate
Related CAS	6004-24-6 (unlabelled)
Canonical SMILES	CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.O.[Cl-]
InChI	InChI=1S/C21H38N.ClH.H2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H;1H2/q+1;;/p-1/i15D,17D,18D,20D,21D;;
InChI Key	NFCRBQADEGXVDL-UGIAOSMXSA-M
Melting Point	81 °C (lit.)
Purity	98% (CP); 98% atom D
Appearance	Solid