2-Biphenyl-4-YL-benzo[D]thiazole

Base Information

• Chemical Name: 2-Biphenyl-4-YL-benzo[D]thiazole
• CAS No.: 67362-98-5
• Molecular Formula: C19H13NS
• Molecular Weight: 287.385
• DSSTox Substance ID: DTXSID60564315
• Nikkaji Number: J691.926J
• Wikidata: Q82448995
• Mol file: 67362-98-5.mol

Synonyms:67362-98-5;2-BIPHENYL-4-YL-BENZO[D]THIAZOLE;2-([1,1'-biphenyl]-4-yl)benzo[d]thiazole;2-([1,1'-Biphenyl]-4-yl)-1,3-benzothiazole;2-{[1,1'-BIPHENYL]-4-YL}-1,3-BENZOTHIAZOLE;SCHEMBL754574;DTXSID60564315;AKOS003629073;2-((1,1'-biphenyl)-4-yl)benzothiazole;2-(4-PHENYLPHENYL)-1,3-BENZOTHIAZOLE;SR-01000400816;SR-01000400816-1;F0060-0235

Chemical Property of 2-Biphenyl-4-YL-benzo[D]thiazole

Chemical Property:

• PSA: 41.13000
• LogP: 5.63030
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 287.07687059
• Heavy Atom Count: 21
• Complexity: 331

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Technology Process of 2-Biphenyl-4-YL-benzo[D]thiazole

There total 35 articles about 2-Biphenyl-4-YL-benzo[D]thiazole 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: 95.0%

2-(4-iodophenyl)benzo[d]thiazole (19654-21-8) + phenylboronic acid (98-80-6) → 2-([1,1′-biphenyl]-4-yl)benzo[d]thiazole (67362-98-5)

Guidance literature:

With 2-Phenylimidazole; potassium carbonate; palladium dichloride; In N,N-dimethyl-formamide; at 120 ℃; for 24h; Inert atmosphere;

DOI:10.1055/s-0031-1289772

Reference yield: 95.0%

2-amino-benzenethiol (137-07-5) + 4-Phenylbenzaldehyde (3218-36-8) → 2-([1,1′-biphenyl]-4-yl)benzo[d]thiazole (67362-98-5)

Guidance literature:

With ammonium cerium(IV) nitrate; dihydrogen peroxide; at 50 ℃; for 0.15h;

DOI:10.1021/jo8010232

Reference yield: 95.0%

biphenyl-4-methylchloride (1667-11-4) + 2-amino-benzenethiol (137-07-5) → 2-([1,1′-biphenyl]-4-yl)benzo[d]thiazole (67362-98-5)

Guidance literature:

With pyridine; sulfur; at 130 ℃; for 20h; Inert atmosphere;

DOI:10.1002/asia.201600355

upstream raw materials:

2-Phenylbenzothiazole

dibenzoyl peroxide

4-biphenyl-carboxylic acid chloride

2-amino-benzenethiol

Downstream raw materials:

[Ir(C₆H₄SNCC₁₂H₈)2Cl]2