4-Phenyl-2-(p-tolyl)thiazole

Base Information

• Chemical Name: 4-Phenyl-2-(p-tolyl)thiazole
• CAS No.: 2227-61-4
• Molecular Formula: C16H13NS
• Molecular Weight: 251.352
• Hs Code.: 2934100090
• European Community (EC) Number: 681-830-6
• Wikidata: Q106902780
• Mol file: 2227-61-4.mol

Synonyms:4-phenyl-2-(p-tolyl)thiazole;2227-61-4;2-(4-METHYLPHENYL)-4-PHENYL-1,3-THIAZOLE;SCHEMBL14081497;AKOS032949293;4-Phenyl-2-(p-tolyl)thiazole, 97%;4-Phenyl-2-(p-tolyl)thiazole, AldrichCPR;2-(4-methylphenyl)-4-phenyl-1, 3-thiazole

Chemical Property of 4-Phenyl-2-(p-tolyl)thiazole

Chemical Property:

• Melting Point: 56-59℃
• Boiling Point: 419.6±48.0 °C(Predicted)
• PKA: 2.02±0.10(Predicted)
• PSA: 41.13000
• Density: 1.147±0.06 g/cm3(Predicted)
• LogP: 4.78550
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 251.07687059
• Heavy Atom Count: 18
• Complexity: 254

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=NC(=CS2)C3=CC=CC=C3

Technology Process of 4-Phenyl-2-(p-tolyl)thiazole

There total 21 articles about 4-Phenyl-2-(p-tolyl)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: 85.0%

1-(1-azido-2-iodoethyl)benzene (4098-17-3) + morpholino(p-tolyl)methanethione (61750-20-7) → 4-phenyl-2-(4′-methylphenyl)thiazole (2227-61-4)

Guidance literature:

With potassium tert-butylate; at 80 ℃; for 7h;

DOI:10.1021/acscombsci.9b00045

Reference yield: 84.0%

2-(4-Methylphenyl)thiazole (27088-83-1) + phenylboronic acid (98-80-6) → 4-phenyl-2-(4′-methylphenyl)thiazole (2227-61-4)

Guidance literature:

With lithium tetrafluoroborate; 1,10-Phenanthroline; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; palladium diacetate; In N,N-dimethyl acetamide; at 100 ℃; for 24h; regioselective reaction;

DOI:10.1039/c3sc52199k

Reference yield: 79.0%

4-methylphenylboronic acid (5720-05-8) + 2-oxo-2-phenylethylthiocyanate (5399-30-4) → 4-phenyl-2-(4′-methylphenyl)thiazole (2227-61-4)

Guidance literature:

With palladium diacetate; In toluene; at 60 ℃; for 24h; Reagent/catalyst; Solvent; Temperature;

upstream raw materials:

3-methyl-4-phenyl-5-sulfo-2-p-tolyl-thiazolium betaine

4-methylthiobenzamide

α-bromoacetophenone

4-Methyl-dithiobenzoic acid 2-[(E)-hydroxyimino]-2-phenyl-ethyl ester

Downstream raw materials:

4-(4-nitrophenyl)-2-(p-tolyl)thiazole

2-(4-Bromomethyl-phenyl)-4-phenyl-thiazole

[4-(4-Phenyl-thiazol-2-yl)-benzyl]-phosphonic acid diethyl ester

4-(2-p-tolyl-thiazol-4-yl)-aniline