Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)-

Base Information

• Chemical Name: Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)-
• CAS No.: 101001-71-2
• Molecular Formula: C21H18 N2 O2 S
• Molecular Weight: 362.4448
• DSSTox Substance ID: DTXSID70143655
• Nikkaji Number: J390.027D
• Wikidata: Q83007635
• Mol file: 101001-71-2.mol

Synonyms:4,5-Bis(4-methoxyphenyl)-2-(pyrrol-2-yl)-thiazole;4,5-Bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)thiazole;Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)-;101001-71-2;SCHEMBL7852125;DTXSID70143655;DYASQUCCIHXBLN-UHFFFAOYSA-N;LS-150812;4,5-Bis(4-methoxyphenyl)-2-(pyrrol-2-yl)thiazole

Chemical Property of Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)-

Chemical Property:

• Vapor Pressure: 6.22E-12mmHg at 25°C
• Boiling Point: 558.5°Cat760mmHg
• Flash Point: 291.5°C
• Density: 1.231g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 362.10889899
• Heavy Atom Count: 26
• Complexity: 436

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=C(SC(=N2)C3=CC=CN3)C4=CC=C(C=C4)OC

Technology Process of Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)-

There total 5 articles about Thiazole, 4,5-bis(4-methoxyphenyl)-2-(1H-pyrrol-2-yl)- 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: 86.0%

2-bromo-1,2-bis(4-methoxyphenyl)ethanone (27895-95-0) + 1H-pyrrole-2-carbothioamide (37488-45-2) → 4,5-bis(4-methoxyphenyl)-2-(pyrrol-2-yl)-thiazole (101001-71-2)

Guidance literature:

In acetonitrile; at 60 ℃;

DOI:10.1248/cpb.39.651

Reference yield:

4,4'-dimethoxybenzoin (119-52-8) → 4,5-bis(4-methoxyphenyl)-2-(pyrrol-2-yl)-thiazole (101001-71-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 89 percent / PBr₃ / CCl₄ / Heating

2: 86 percent / acetonitrile / 60 °C

With phosphorus tribromide; In tetrachloromethane; acetonitrile;

DOI:10.1248/cpb.39.651

Reference yield:

→ 4,5-bis(4-methoxyphenyl)-2-(pyrrol-2-yl)-thiazole (101001-71-2)

Guidance literature:

upstream raw materials:

2-bromo-1,2-bis(4-methoxyphenyl)ethanone

1H-pyrrole-2-carbothioamide

4,4'-dimethoxybenzoin