5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylic acid

Base Information

• Chemical Name: 5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylic acid
• CAS No.: 52041-97-1
• Molecular Formula: C₁₀H₅BrClNO₂S
• Molecular Weight: 318.578
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID90682152
• Wikidata: Q82606443
• Mol file: 52041-97-1.mol

Synonyms:5-BROMO-2-(4-CHLOROPHENYL)THIAZOLE-4-CARBOXYLIC ACID;52041-97-1;5-bromo-2-(4-chlorophenyl)-1,3-thiazole-4-carboxylic acid;5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylicacid;DTXSID90682152;CCA04197;MFCD17214270;AKOS015835160;BS-28576;CS-0212150;A871090

Chemical Property of 5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylic acid

Chemical Property:

• PSA: 78.43000
• LogP: 3.92420
• Storage Temp.: Room temperature.
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 316.89129
• Heavy Atom Count: 16
• Complexity: 274

Purity/Quality:

97% ^*data from raw suppliers

5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=NC(=C(S2)Br)C(=O)O)Cl

Technology Process of 5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylic acid

There total 7 articles about 5-Bromo-2-(4-chlorophenyl)thiazole-4-carboxylic acid 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:

[5-bromo-2-(4-chloro-phenyl)-thiazol-4-yl]-methanol (52041-83-5) → 5-bromo-2-(4-chloro-phenyl)-thiazole-4-carboxylic acid (52041-97-1)

Guidance literature:

With sodium hydroxide; potassium permanganate; for 5h; Ambient temperature;

DOI:10.1002/ardp.19743070202

Reference yield:

[2-(4-chloro-phenyl)-thiazol-4-yl]-methanol (36093-99-9) → 5-bromo-2-(4-chloro-phenyl)-thiazole-4-carboxylic acid (52041-97-1)

Guidance literature:

With sodium hydroxide; potassium permanganate; for 3h; Ambient temperature;

DOI:10.1002/ardp.19743070202

Reference yield:

2-(4-chlorophenyl)thiazole-4-carbaldehyde (21278-77-3) → 5-bromo-2-(4-chloro-phenyl)-thiazole-4-carboxylic acid (52041-97-1)

Guidance literature:

Multi-step reaction with 4 steps

1: aq. KOH

2: Br₂ / acetic acid / 0.5 h / Ambient temperature

3: Na₂Cr₂O₇*2H₂O / acetic acid

4: KMnO₄, aq. NaOH / 3 h / Ambient temperature

With potassium hydroxide; sodium hydroxide; potassium permanganate; sodium dichromate; bromine; In acetic acid;

DOI:10.1002/ardp.19743070202

upstream raw materials:

[5-bromo-2-(4-chloro-phenyl)-thiazol-4-yl]-methanol

5-bromo-2-(4-chloro-phenyl)-thiazole-4-carbaldehyde

[2-(4-chloro-phenyl)-thiazol-4-yl]-methanol

3-bromo-4-(chloromethyl)-2-(4-chlorophenyl)thiazole

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