4-(4-Methylphenyl)-1,3-thiazole

Base Information

• Chemical Name: 4-(4-Methylphenyl)-1,3-thiazole
• CAS No.: 1826-19-3
• Molecular Formula: C₁₀H₉NS
• Molecular Weight: 175.254
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID101310984
• Nikkaji Number: J1.797.831D
• Mol file: 1826-19-3.mol

Synonyms:4-(4-methylphenyl)-1,3-thiazole;1826-19-3;4-(p-Tolyl)thiazole;4-(4-methylphenyl)thiazole;SCHEMBL10284703;KHTXVFJHWRJTOR-UHFFFAOYSA-N;DTXSID101310984;BAA82619;BBL021787;MFCD02665781;STK894504;AKOS005144566;BS-27495;CS-0188204;E84704;EN300-4994897

Chemical Property of 4-(4-Methylphenyl)-1,3-thiazole

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 175.04557046
• Heavy Atom Count: 12
• Complexity: 141

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-(4-Methylphenyl)-1,3-thiazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CSC=N2

Technology Process of 4-(4-Methylphenyl)-1,3-thiazole

There total 6 articles about 4-(4-Methylphenyl)-1,3-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: 78.0%

C23H19NOS → 4-(4-methylphenyl)thiazole (1826-19-3)

Guidance literature:

With caesium carbonate; In m-xylene; at 150 ℃; for 40h; regioselective reaction;

DOI:10.1039/c3sc52199k

Reference yield: 27.0%

3-Isopropoxy-4-p-tolyl-3H-thiazole-2-thione (220222-34-4) → 4-(4-methylphenyl)thiazole (1826-19-3) + 4,4'-(p-tolyl)-2,2'-bithiazyl + bis-[4-(4-methylphenyl)-2-thiazyl]disulfide + (Z)-1-(4-methylphenyl)-2-[4-(4-methylphenyl)-2-thiazylsulfanyl]ethenyl-1-isothiocyanate

Guidance literature:

In water; acetonitrile; at 0 ℃; for 1h; Photolysis;

DOI:10.1021/jo025856w

Reference yield:

4-methylphenylboronic acid (5720-05-8) + 4-bromo-1,3-thiazole (34259-99-9) → 4-(4-methylphenyl)thiazole (1826-19-3)

Guidance literature:

With potassium phosphate; NiCl₂(PCy₃)2; In 2-methyltetrahydrofuran; at 100 ℃; for 12h; Solvent; Temperature; Inert atmosphere; Sealed tube;

DOI:10.1021/ol401727y

upstream raw materials:

thiocarboxamide

4-(bromoacetyl)toluene

3-Isopropoxy-4-p-tolyl-3H-thiazole-2-thione

4-methylphenylboronic acid

Downstream raw materials:

2-(2-propylpyridin-4-yl)-4-p-tolylthiazole

2-methylmercapto-4-(4'-methylphenyl)thiazole