2-(4-Tert-butylphenyl)-1,3-benzothiazole

Base Information

Chemical Name:2-(4-Tert-butylphenyl)-1,3-benzothiazole
CAS No.:56048-52-3
Molecular Formula:C17H17NS
Molecular Weight:267.395
Hs Code.:
DSSTox Substance ID:DTXSID60351782
Nikkaji Number:J347.911K
Wikidata:Q82128490
Pharos Ligand ID:H7QJNAPTBVPY
ChEMBL ID:CHEMBL1699128
Mol file:56048-52-3.mol

Synonyms:2-(4-tert-butylphenyl)-1,3-benzothiazole;56048-52-3;2-(4-TERT-BUTYL-PHENYL)-BENZOTHIAZOLE;MLS-0412171.0001;HMS1549I19;TimTec1_005475;cid_709072;CHEMBL1699128;SCHEMBL13118015;BDBM62265;DTXSID60351782;RBKGJKUWWDNBNT-UHFFFAOYSA-N;ARK102853;STK299594;AKOS001706425;2-(4-tert-butylphenyl)benzo[d]thiazole;Benzothiazole, 2-(4-tert-butylphenyl)-;NCGC00173184-02;AB01332258-02;BRD-K83739481-001-02-2

Suppliers and Price of 2-(4-Tert-butylphenyl)-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 4 raw suppliers

Chemical Property of 2-(4-Tert-butylphenyl)-1,3-benzothiazole

Chemical Property:

PSA：41.13000
LogP:5.26080
XLogP3:5.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:267.10817072
Heavy Atom Count:19
Complexity:301

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=CC=C(C=C1)C2=NC3=CC=CC=C3S2

Technology Process of 2-(4-Tert-butylphenyl)-1,3-benzothiazole

There total 36 articles about 2-(4-Tert-butylphenyl)-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: 99.0%

: 120951-35-1
4-(tert-butyl)-N-phenylbenzothioamide

: 56048-52-3
2-(4-tert-butylphenyl)benzothiazole

Guidance literature:: With dmap; Co^III(dimethylglyoximate)₂(4-NMe₂-C₅H₄N)Cl; [Ni(2,2'-bipyridine)₃][PF₆]₂; sodium glycinate; In acetonitrile; at 20 ℃; for 12h; Reagent/catalyst; Inert atmosphere; Irradiation; Schlenk technique;
DOI:10.1021/jacs.5b05665

Reference yield: 98.0%

: N-(2-bromophenyl)-4-(tert-butyl)benzothioamide

: 56048-52-3
2-(4-tert-butylphenyl)benzothiazole

Guidance literature:: With sodium phosphate; In dimethyl sulfoxide; at 20 ℃; for 3h; Inert atmosphere; Irradiation;
DOI:10.1021/acs.orglett.1c00235

Reference yield: 95.0%

: 39895-55-1
4-(1,1-dimethylethyl)-benzenemethanamine

: 137-07-5
2-amino-benzenethiol

: 56048-52-3
2-(4-tert-butylphenyl)benzothiazole

Guidance literature:: With palladium 10% on activated carbon; In dodecane; N,N-dimethyl acetamide; at 120 ℃; for 28h; Inert atmosphere;
DOI:10.1039/c3ob40388b