5-Methyl-3-phenyl-1,2-benzothiazole

Base Information

Chemical Name:5-Methyl-3-phenyl-1,2-benzothiazole
CAS No.:117136-81-9
Molecular Formula:C14H11NS
Molecular Weight:225.314
Hs Code.:
DSSTox Substance ID:DTXSID40556536
Nikkaji Number:J1.818.558J
Wikidata:Q82438110

Synonyms:5-Methyl-3-phenyl-1,2-benzothiazole;117136-81-9;DTXSID40556536

Suppliers and Price of 5-Methyl-3-phenyl-1,2-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 1 raw suppliers

Chemical Property of 5-Methyl-3-phenyl-1,2-benzothiazole

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:225.06122053
Heavy Atom Count:16
Complexity:237

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC2=C(C=C1)SN=C2C3=CC=CC=C3

Technology Process of 5-Methyl-3-phenyl-1,2-benzothiazole

There total 3 articles about 5-Methyl-3-phenyl-1,2-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: 94.0%

: 117136-73-9
(5-Methyl-2-methylsulfanyl-phenyl)-phenyl-methanone oxime

: 117136-81-9
5-methyl-3-phenyl-1,2-benzisothiazole

Guidance literature:: With acetic anhydride; In pyridine; for 24h; Heating;

Reference yield: 61.0%

: 623-13-2
4-methylphenyl methylsulfide

: 100-47-0
benzonitrile

: 117136-81-9
5-methyl-3-phenyl-1,2-benzisothiazole

Guidance literature:: 4-methylphenyl methylsulfide; With n-butyllithium; N,N,N,N,-tetramethylethylenediamine; In tert-butyl methyl ether; at 20 ℃; for 3h; Inert atmosphere; Schlenk technique;

benzonitrile; In tert-butyl methyl ether; at 20 ℃; for 24h; Inert atmosphere; Schlenk technique;
DOI:10.1021/acs.orglett.8b00850

Reference yield:

: 24852-91-3
5-methyl-2-methylsulfanyl-benzophenone

: 117136-81-9
5-methyl-3-phenyl-1,2-benzisothiazole

Guidance literature:: Multi-step reaction with 2 steps

1: hydroxylamine hydrochloride / ethanol; pyridine / 24 h / Heating

2: 94 percent / acetic anhydride / pyridine / 24 h / Heating

With hydroxylamine hydrochloride; acetic anhydride; In pyridine; ethanol;