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416452 Sigma-Aldrich

Dimethyl sulfide-d6

99 atom % D

Synonym: (Methyl sulfide)-d6, Hexadeuterodimethyl sulfide

  • CAS Number 926-09-0

  • Linear Formula CD3SCD3

  • Molecular Weight 68.17

  •  Beilstein/REAXYS Number 2036892

  •  EC Number 213-133-6

  •  MDL number MFCD00044687

  •  PubChem Substance ID 24865904

  •  NACRES NA.21

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Properties

Related Categories Additional NMR Solvents, Alphabetical Listings, D, NMR Solvents, NMR Solvents and Reagents,
Quality Level   200
isotopic purity   99 atom % D
assay   99% (CP)
form   liquid
application(s)   NMR: suitable
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
SMILES string   [2H]C([2H])([2H])SC([2H])([2H])[2H]
InChI   1S/C2H6S/c1-3-2/h1-2H3/i1D3,2D3
InChI key   QMMFVYPAHWMCMS-WFGJKAKNSA-N

Description

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.

Packaging

1, 5 g in ampule

Safety & Documentation

Safety Information

Symbol 
GHS02  GHS02
Signal word 
Danger
Hazard statements 
Precautionary statements 
RIDADR 
UN1164 - class 3 - PG 2 - Dimethyl sulfide
WGK Germany 
WGK 1
Flash Point(F) 
-34.6 °F - closed cup
Flash Point(C) 
-37 °C - closed cup
Protocols & Articles

Articles

Pressure-Temperature Calculator for Solvents

*Calculations provide estimated results based on Antoine's Coefficients and their associated temperature range values. Antoine's Coefficients were obtained from the National Institute of Standards an...

Peer-Reviewed Papers
15

References

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