Butyl ethyldithiocarbamate

Base Information

• Chemical Name: Butyl ethyldithiocarbamate
• CAS No.: 83962-20-3
• Molecular Formula: C7H15NS2
• Molecular Weight: 177.335
• Hs Code.: 2930909090
• European Community (EC) Number: 281-488-4
• DSSTox Substance ID: DTXSID901004175
• Nikkaji Number: J296.296I
• Wikidata: Q82999041
• Mol file: 83962-20-3.mol

Synonyms:Butyl ethyldithiocarbamate;83962-20-3;EINECS 281-488-4;SCHEMBL9180183;YSMHAOJOUCBJNV-UHFFFAOYSA-N;DTXSID901004175;Butyl hydrogen ethylcarbonodithioimidate;NS00060036

Chemical Property of Butyl ethyldithiocarbamate

Chemical Property:

• Vapor Pressure: 0.0389mmHg at 25°C
• Refractive Index: 1.533
• Boiling Point: 240 °C at 760 mmHg
• Flash Point: 99 °C
• PSA: 76.46000
• Density: 1.031 g/cm³
• LogP: 2.82540
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 177.06459183
• Heavy Atom Count: 10
• Complexity: 93.6

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSC(=S)NCC

Technology Process of Butyl ethyldithiocarbamate

There total 1 articles about Butyl ethyldithiocarbamate 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:

1-bromo-butane (109-65-9) + carbon disulfide (75-15-0,12122-00-8) + ethylamine (75-04-7,85404-22-4) → butyl ethyldithiocarbamate (83962-20-3)

Guidance literature:

With triethylamine; Yield given. Multistep reaction; 1) chloroform, 3 h, room temp.; 2) room temp., 3 h;

Reference yield: 87.0%

butyl ethyldithiocarbamate (83962-20-3) → n-butanethiol (109-79-5) + Ethyl isothiocyanate (542-85-8)

Guidance literature:

at 250 - 260 ℃;

upstream raw materials:

1-bromo-butane

carbon disulfide

ethylamine

Downstream raw materials:

n-butanethiol

Ethyl isothiocyanate