2-(Butane-1-sulfinyl)-1,3-benzothiazole

Base Information

Chemical Name:2-(Butane-1-sulfinyl)-1,3-benzothiazole
CAS No.:79252-73-6
Molecular Formula:C₁₁H₁₃NOS₂
Molecular Weight:239.362
Hs Code.:
NSC Number:191787
DSSTox Substance ID:DTXSID20307482

Synonyms:79252-73-6;NSC191787;SCHEMBL10925047;DTXSID20307482;NSC-191787;2-(BUTANE-1-SULFINYL)-1,3-BENZOTHIAZOLE

Suppliers and Price of 2-(Butane-1-sulfinyl)-1,3-benzothiazole

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 6 raw suppliers

Chemical Property of 2-(Butane-1-sulfinyl)-1,3-benzothiazole

Chemical Property:

Vapor Pressure:3.98E-06mmHg at 25°C
Boiling Point:396.2°Cat760mmHg
Flash Point:193.4°C
Density:1.3g/cm³
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:239.04385639
Heavy Atom Count:15
Complexity:235

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCS(=O)C1=NC2=CC=CC=C2S1

Technology Process of 2-(Butane-1-sulfinyl)-1,3-benzothiazole

There total 3 articles about 2-(Butane-1-sulfinyl)-1,3-benzothiazole 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: 96.8%

: 2314-17-2
2-(but-1-ylthio)benzo[d]thiazole

: 79252-73-6
2-(butylsulfinyl)benzo[d]thiazole

Guidance literature:: With 1,1'-dihydroperoxydicyclohexyl peroxide; In methanol; at 45 ℃; for 36h;
DOI:10.1016/j.tet.2021.132203

Reference yield:

: 149-30-4,118090-09-8
2-Mercaptobenzothiazole

: 79252-73-6
2-(butylsulfinyl)benzo[d]thiazole

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / acetone / 0.17 h / 20 °C / Sonication

2: 1,1'-dihydroperoxydicyclohexyl peroxide / methanol / 36 h / 45 °C

With 1,1'-dihydroperoxydicyclohexyl peroxide; triethylamine; In methanol; acetone;
DOI:10.1016/j.tet.2021.132203