(5Z)-5-benzylidene-2-(4-chlorophenyl)-4-phenyl-4H-1,3-thiazole

Base Information

• Chemical Name: (5Z)-5-benzylidene-2-(4-chlorophenyl)-4-phenyl-4H-1,3-thiazole
• CAS No.: 59824-79-2
• Molecular Formula: C₂₂H₁₆ClNS
• Molecular Weight: 361.895
• NSC Number: 282489
• DSSTox Substance ID: DTXSID90418498
• Mol file: 59824-79-2.mol

Synonyms:NSC282489;59824-79-2;DTXSID90418498;NSC-282489

Chemical Property of (5Z)-5-benzylidene-2-(4-chlorophenyl)-4-phenyl-4H-1,3-thiazole

Chemical Property:

• Vapor Pressure: 9.67E-11mmHg at 25°C
• Boiling Point: 528.9°C at 760 mmHg
• Flash Point: 273.7°C
• Density: 1.2g/cm³
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 361.0691984
• Heavy Atom Count: 25
• Complexity: 494

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)C=C2C(N=C(S2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4
• Isomeric SMILES: C1=CC=C(C=C1)/C=C\2/C(N=C(S2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Technology Process of (5Z)-5-benzylidene-2-(4-chlorophenyl)-4-phenyl-4H-1,3-thiazole

There total 1 articles about (5Z)-5-benzylidene-2-(4-chlorophenyl)-4-phenyl-4H-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:

benzaldehyde (100-52-7) + phenylacetylene (536-74-3) + 4-chlorothiobenzamide (2521-24-6) → 5-benzylidene-2-(4-chloro-phenyl)-4-phenyl-4,5-dihydro-thiazole (59824-79-2) + 2-(4-chlorophenyl)-4,6-diphenyl-4H-1,3-thiazine (54665-83-7)

Guidance literature:

With boron trifluoride diethyl etherate; In chloroform; at 15 ℃; for 16h;

Reference yield:

5-benzylidene-2-(4-chloro-phenyl)-4-phenyl-4,5-dihydro-thiazole (59824-79-2) → 5-benzyl-2-(4-chlorophenyl)-4-phenylthiazole (59824-84-9)

Guidance literature:

With triethylamine; In diethyl ether; Ambient temperature;

upstream raw materials:

benzaldehyde

phenylacetylene

4-chlorothiobenzamide

Downstream raw materials:

5-benzyl-2-(4-chlorophenyl)-4-phenylthiazole