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588393

Sigma-Aldrich

Cetyl(pyridinium-d5) chloride monohydrate

98 atom % D, 98% (CP)

Synonym(s):

Hexadecyl-(pyridinium-d5)-chloride monohydrate

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About This Item

Empirical Formula (Hill Notation):
C21D5H33ClN·H2O
Molecular Weight:
363.03
MDL number:
MFCD08702799
UNSPSC Code:
12352005
PubChem Substance ID:
329758497

isotopic purity

98 atom % D

Assay

98% (CP)

form

solid

mp

81 °C (lit.)

mass shift

M+5

SMILES string

O.[Cl-].[2H]c1c([2H])c([2H])[n+](CCCCCCCCCCCCCCCC)c([2H])c1[2H]

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

Related Categories

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Pictograms

Skull and crossbones
GHS06

Signal Word

Danger

Hazard Statements

H301,H315,H330

Hazard Classifications

Acute Tox. 3 Oral - Skin Irrit. 2

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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