Di((2H3)methyl) sulphide

Base Information

• Chemical Name: Di((2H3)methyl) sulphide
• CAS No.: 926-09-0
• Molecular Formula: C2D6 S
• Molecular Weight: 68.088
• European Community (EC) Number: 213-133-6
• DSSTox Substance ID: DTXSID80239058
• Nikkaji Number: J298.492J
• Wikidata: Q83121405
• Mol file: 926-09-0.mol

Synonyms:926-09-0;Dimethyl sulfide-d6;Di((2H3)methyl) sulphide;trideuterio(trideuteriomethylsulfanyl)methane;EINECS 213-133-6;1,1'-Thiobismethane-d3 (Dimethyl Sulfide-d6);Di[(2H3)methyl] sulphide;(Methyl sulfide)-d6;Hexadeuterodimethyl sulfide;Di(2H3)methyl sulfide;DIMETHYL-D6 SULFIDE;C2D6S;C2-D6-S;DTXSID80239058;Dimethyl sulfide-d6, 99 atom % D;AKOS015912413

Chemical Property of Di((2H3)methyl) sulphide

Chemical Property:

• Vapor Pressure: 647mmHg at 25°C
• Refractive Index: n20/D 1.431(lit.)
• Boiling Point: 29.5°Cat760mmHg
• Flash Point: °C
• Density: 0.822g/cm³
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 68.05668184
• Heavy Atom Count: 3
• Complexity: 2.8

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,1’-Thiobismethane-d3(DimethylSulfide-d6) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,Xn
• Statements: 22-36/37/38-41
• Safety Statements: 16-23-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Sulfur Compounds
• Canonical SMILES: CSC
• Isomeric SMILES: [2H]C([2H])([2H])SC([2H])([2H])[2H]

Technology Process of Di((2H3)methyl) sulphide

There total 11 articles about Di((2H3)methyl) sulphide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

((methyl-d3)sulfonyl)methane-d3 (22230-82-6) → dimethyl sulfide-d6 (926-09-0)

Guidance literature:

With triphenylphosphine; In tetrachloromethane;

Reference yield:

dimethylsulfoxide-d6 (2206-27-1) + methyl iodide (74-88-4) → methanol (67-56-1) + Dimethyl ether (115-10-6,157621-61-9) + dimethyl ether-d6 (17222-37-6) + dimethylsulfoxide-d5 + Methyl(trideuteriomethyl)sulfid (4752-12-9) + dimethyl sulfide-d6 (926-09-0) + dimethylsulphoxide-d3 (21892-74-0) + <2H9>trimethylsulphoxonium iodide (23726-00-3) + trimethylsulphoxonium-d6 iodide (78730-02-6)

Guidance literature:

In 1,4-dioxane; at 21.84 ℃; Time; Sealed tube;

DOI:10.1080/17415993.2015.1066376

Reference yield:

1-ethenyl-4-methylbenzene (622-97-9,24936-41-2) + N-toluylsulfonyl S-difluoromethyl S-phenyl sulfoximine (1097192-99-8) → dimethyl sulfide-d6 (926-09-0) + 3,3-difluoro-1-(4-methylphenyl)propanone

Guidance literature:

With fac-tris(2-phenylpyridinato-N,C₂')iridium(III); In dimethylsulfoxide-d6; at 20 ℃; for 0.5h; Irradiation;

DOI:10.1021/acscatal.9b01312

upstream raw materials:

dimethylsulfoxide-d6

((methyl-d3)sulfonyl)methane-d3

C₂H⁽²⁾H₆OS

methyl iodide

Downstream raw materials:

perdeuteriated trimethylsulfonium iodide

dimethylsulfoxide-d6

((methyl-d3)sulfonyl)methane-d3

dimethylsulfide