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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

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Skin Irrit. 2

Storage Class

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

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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Certificates of Analysis (COA)

Lot/Batch Number
MBBC5650
EQ1048

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