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Merck
CN

416452

二甲基硫-d6

99 atom % D

别名:

(Methyl sulfide)-d6, Hexadeuterodimethyl sulfide

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关于此项目

线性分子式:
CD3SCD3
化学文摘社编号:
分子量:
68.17
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
EC Number:
213-133-6
Beilstein/REAXYS Number:
2036892
MDL number:
Isotopic purity:
99 atom % D
Assay:
99% (CP)
Mass shift:
M+6
Form:
liquid
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InChI key

QMMFVYPAHWMCMS-WFGJKAKNSA-N

InChI

1S/C2H6S/c1-3-2/h1-2H3/i1D3,2D3

SMILES string

[2H]C([2H])([2H])SC([2H])([2H])[2H]

isotopic purity

99 atom % D

assay

99% (CP)

form

liquid

Quality Level

refractive index

n20/D 1.431 (lit.)

bp

36.5 °C (lit.)

density

0.928 g/mL at 25 °C (lit.)

mass shift

M+6

General description

Dimethyl sulfide-d6 [(CD3)2S] is a deuterated NMR solvent useful in NMR-based research and analyses. It can form 1:1 complex with halothane by the formation of C–H…S hydrogen bonds. During the reaction of (CD3)2S with singlet oxygen in aprotic solvents, the H-D exchange in the methyl group was observed. The electronic spectra of (CD3)2S has been measured between 1250 and 2500Å.

Other Notes

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pictograms

Flame

signalword

Danger

hcodes

Hazard Classifications

Flam. Liq. 2

存储类别

3 - Flammable liquids

wgk

WGK 1

flash_point_f

-34.6 °F - closed cup

flash_point_c

-37 °C - closed cup

法规信息

危险化学品
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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Vibrational spectra of (CH3)2S, CH3SCD3, and (CD3)2S.
Ypenburg JW and Gerding H.
Rec. Trav. Chim., 90(8), 885-895 (1971)
C-H?X (X= S, P) hydrogen bonding: The complexes of halothane with dimethyl sulfide and trimethylphosphine.
Michielsen B, et al.
Journal of Molecular Structure, 1023, 90-95 (2012)
Intramolecular potential function and methyl-methyl coupling of crystalline dimethyl sulfide.
Levin IW, et al.
Spectrochimica Acta Part A: Molecular Spectroscopy, 31(1), 41-55 (1975)
Assignments of Rydberg and valence transitions in the electronic absorption spectrum of dimethyl sulfide.
McDiarmid R.
J. Chem. Phys. , 61(1), 274-281 (1974)
Mechanism of sulfone formation in the reaction of sulfides and singlet oxygen: intermediacy of S-hydroperoxysulfonium ylide.
Ishiguro K, et al.
Journal of the American Chemical Society, 118(31), 7265-7271 (1996)

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