2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid

Base Information

• Chemical Name: 2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid
• CAS No.: 253315-24-1
• Molecular Formula: C₁₁H₈ClNO₂S
• Molecular Weight: 253.709
• European Community (EC) Number: 841-572-9
• Mol file: 253315-24-1.mol

Synonyms:2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid;253315-24-1;MFCD00665647;2-(2-chlorophenyl)-4-methylthiazole-5-carboxylic acid;SCHEMBL3418888;BBL028854;STL226784;AKOS002669843;12F-344S;EN300-60758;F1967-1354;Z384974884;2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylicAcid

Chemical Property of 2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 252.9964274
• Heavy Atom Count: 16
• Complexity: 277

Purity/Quality:

98%min ^*data from raw suppliers

2-(2-Chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(SC(=N1)C2=CC=CC=C2Cl)C(=O)O
• Uses: 2-(2-Chlorophenyl)-4-methyl-5-thiazolecarboxylic acid is used as a reactant in the preparation of heterocyclecarboxylic acid, benzoic acid, and phenylalkanoic acid derivatives as agonists of peroxisome proliferator-activated receptors (PPAR) for prevention and/or treatment of diseases.

Technology Process of 2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-carboxylic Acid

There total 4 articles about 2-(2-chlorophenyl)-4-methyl-1,3-thiazole-5-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:

ethyl 2-(2-chlorophenyl)-4-methylthiazole-5-carboxylate (338982-17-5) → 2-(2-chlorophenyl)-4-methylthiazole-5-carboxylic acid (253315-24-1)

Guidance literature:

With lithium hydroxide monohydrate; In methanol; water; Inert atmosphere;

DOI:10.3987/COM-13-12865

Reference yield:

2-chlorothiobenzamide (15717-17-6) → 2-(2-chlorophenyl)-4-methylthiazole-5-carboxylic acid (253315-24-1)

Guidance literature:

Multi-step reaction with 2 steps

1: ethanol / 2 h / Reflux; Inert atmosphere

2: lithium hydroxide monohydrate / methanol; water / Inert atmosphere

With lithium hydroxide monohydrate; In methanol; ethanol; water;

DOI:10.3987/COM-13-12865

Reference yield:

2-chlorobenzamide (609-66-5) → 2-(2-chlorophenyl)-4-methylthiazole-5-carboxylic acid (253315-24-1)

Guidance literature:

Multi-step reaction with 3 steps

1: Lawessons reagent / toluene / 6 h / 60 °C / Inert atmosphere; Schlenk technique

2: ethanol / 4 h / Reflux

3: lithium hydroxide / ethanol / 20 °C

With Lawessons reagent; lithium hydroxide; In ethanol; toluene;

DOI:10.1111/cbdd.12729

upstream raw materials:

2-chlorothiobenzamide

ethyl 2-(2-chlorophenyl)-4-methylthiazole-5-carboxylate

2-chlorobenzamide

Downstream raw materials:

3-{4-Methoxy-3-[({[4-methyl-2-(2-chlorophenyl)-1,3-thiazol-5-yl]carbonyl}amino)methyl]phenyl)benzoic acid

3-{4-Methoxy-3-[({[4-methyl-2-(2-chlorophenyl)-1,3-thiazol-5-yl]carbonyl}amino)methyl]-phenyl}-6-methoxybenzoic acid

C₂₃H₂₂ClN₃O₃S

C₁₅H₁₅ClN₂O₃S

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