Cyclohexyl diethylcarbamodithioate

Base Information

• Chemical Name: Cyclohexyl diethylcarbamodithioate
• CAS No.: 56905-28-3
• Molecular Formula: C11H21NS2
• Molecular Weight: 231.426
• DSSTox Substance ID: DTXSID10571059
• Mol file: 56905-28-3.mol

Synonyms:Cyclohexyl diethylcarbamodithioate;56905-28-3;DTXSID10571059

Chemical Property of Cyclohexyl diethylcarbamodithioate

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 231.11154202
• Heavy Atom Count: 14
• Complexity: 172

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)C(=S)SC1CCCCC1

Technology Process of Cyclohexyl diethylcarbamodithioate

There total 3 articles about Cyclohexyl diethylcarbamodithioate 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: 61.0%

1-bromocyclohexane (108-85-0) + disulfiram (97-77-8) → Diethyl-dithiocarbamic acid cyclohexyl ester (56905-28-3)

Guidance literature:

With caesium carbonate; In dimethylsulfoxide-d6; at 60 ℃; for 12h;

DOI:10.1016/j.tetlet.2019.01.044

Reference yield:

diethylammonium diethyldithiocarbamate (1518-58-7) + cyclohexene (110-83-8) → Diethyl-dithiocarbamic acid cyclohexyl ester (56905-28-3)

Guidance literature:

With carbon disulfide; under 6080000 Torr;

DOI:10.1016/0040-4020(75)85058-7

Reference yield:

cyclohexyl tosylate (953-91-3) + diethylammonium diethyldithiocarbamate (1518-58-7) → Diethyl-dithiocarbamic acid cyclohexyl ester (56905-28-3)

Guidance literature:

In ethanol;

DOI:10.1016/0040-4020(75)85058-7

upstream raw materials:

cyclohexyl tosylate

diethylammonium diethyldithiocarbamate

cyclohexene

1-bromocyclohexane

Refernces