4-tert-Butyl-2H-1,3-dithiole-2-thione

Base Information

Chemical Name:4-tert-Butyl-2H-1,3-dithiole-2-thione
CAS No.:29507-67-3
Molecular Formula:C7H10S3
Molecular Weight:190.34900
Hs Code.:
DSSTox Substance ID:DTXSID70498132
Nikkaji Number:J1.532.516J
Mol file:29507-67-3.mol

Synonyms:4-tert-Butyl-2H-1,3-dithiole-2-thione;29507-67-3;SCHEMBL8848555;DTXSID70498132;4-TERT-BUTYL-1,3-DITHIOLE-2-THIONE;Z212050898

Suppliers and Price of 4-tert-Butyl-2H-1,3-dithiole-2-thione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of 4-tert-Butyl-2H-1,3-dithiole-2-thione

Chemical Property:

PSA：88.57000
LogP:3.83660
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:189.99446384
Heavy Atom Count:10
Complexity:186

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CSC(=S)S1

Technology Process of 4-tert-Butyl-2H-1,3-dithiole-2-thione

There total 3 articles about 4-tert-Butyl-2H-1,3-dithiole-2-thione 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: 85.0%

: 1005-56-7
phenylcarbonochloridothioate

: 360055-65-8
3,3-dimethyl-1,2-bis-triisopropylsilanylsulfanyl-but-1-ene

: 29507-67-3
t-butyl-4 dithiole-1,3 thiones-2

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; toluene; at 0 ℃;
DOI:10.1016/S0040-4020(01)00517-8

Reference yield: 51.0%

: 463-71-8
thiophosgene

: 360055-65-8
3,3-dimethyl-1,2-bis-triisopropylsilanylsulfanyl-but-1-ene

: 29507-67-3
t-butyl-4 dithiole-1,3 thiones-2

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; toluene; at 0 ℃;
DOI:10.1016/S0040-4020(01)00517-8

Reference yield:

: 917-92-0
3,3-Dimethylbut-1-yne

: 29507-67-3
t-butyl-4 dithiole-1,3 thiones-2

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / Pd(PPh₃)4 / benzene / 15 h / 90 °C

2: 51 percent / Bu₄NF / toluene; tetrahydrofuran / 0 °C

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; tetrabutyl ammonium fluoride; In tetrahydrofuran; toluene; benzene;
DOI:10.1016/S0040-4020(01)00517-8