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Merck

296147

Dimethyl sulfoxide-d6

99.9 atom % D, contains 0.03 % (v/v) TMS

Synonym(s):

(Methyl sulfoxide)-d6, DMSO-d6, Hexadeuterodimethyl sulfoxide

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About This Item

Linear Formula:
(CD3)2SO
CAS Number:
Molecular Weight:
84.17
UNSPSC Code:
12191502
NACRES:
NA.21
PubChem Substance ID:
EC Number:
218-617-0
Beilstein/REAXYS Number:
1237248
MDL number:
Isotopic purity:
99.9 atom % D
Assay:
99% (CP)
Mass shift:
M+6
Form:
liquid
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vapor pressure

0.42 mmHg ( 20 °C)

Quality Segment

isotopic purity

99.9 atom % D

assay

99% (CP)

form

liquid

autoignition temp.

573 °F

contains

0.03 % (v/v) TMS

expl. lim.

42 %

technique(s)

NMR: suitable

impurities

≤0.0250% water
water

refractive index

n20/D 1.476 (lit.)

bp

189 °C (lit.)

mp

20.2 °C (lit.)

density

1.190 g/mL at 25 °C (lit.)

mass shift

M+6

SMILES string

[2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

InChI

1S/C2H6OS/c1-4(2)3/h1-2H3/i1D3,2D3

InChI key

IAZDPXIOMUYVGZ-WFGJKAKNSA-N

General description

Dimethyl sulfoxide-d6 is a deuterated NMR solvent that is useful in NMR-based research and analyses.

Application


  • Estimation of dissociation constants (pKa′s) of oximes from proton chemical shifts in dimethyl sulfoxide solution: This research utilizes Dimethyl sulfoxide-d₆ (DMSO-d₆) to determine pKa values of oximes, demonstrating its crucial role in enhancing the accuracy of proton NMR spectroscopy for chemical analysis and research within pharmaceutical contexts (Kurtz AP, D′Silva TD, 1987).

  • Proton nuclear magnetic resonance studies on methylthiohydantoins, thiohydantoins, and hydantoins of amino acids: DMSO-d₆ is extensively employed to investigate the structure and behavior of various hydantoin derivatives in amino acid research, proving essential for understanding protein structures and functions, with implications for both academic and pharmaceutical industries (Suzuki T, Tomioka T, Tuzimura K, 1977).

Other Notes

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Storage Class

10 - Combustible liquids

wgk

WGK 1

flash_point_f

190.4 °F

flash_point_c

88 °C

ppe

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)



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