Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate

Base Information

• Chemical Name: Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate
• CAS No.: 132089-36-2
• Molecular Formula: C12H10 Cl N O2 S
• Molecular Weight: 267.736
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID80569504
• Wikidata: Q82456665
• Mol file: 132089-36-2.mol

Synonyms:132089-36-2;Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate;2-(2-CHLORO-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER;ethyl 2-(2-chlorophenyl)-1,3-thiazole-4-carboxylate;2-(2-chlorophenyl)thiazole-4-carboxylic acid ethyl ester;Ethyl2-(2-chlorophenyl)thiazole-4-carboxylate;ethyl 2-(2-chlorophenyl)-4-thiazolecarboxylate;SCHEMBL5896297;2-(2-chlorophenyl)-thiazole-4-carboxylic acid ethyl ester;DTXSID80569504;FHKIJGQXQOGHAL-UHFFFAOYSA-N;MFCD06738334;AKOS016003523;AB26922;BS-20661;CS-0342173;E85834;A806365;W-205391;4-Thiazolecarboxylic acid, 2-(2-chlorophenyl)-, ethyl ester

Chemical Property of Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.588
• Boiling Point: 396.594°C at 760 mmHg
• Flash Point: 193.654°C
• PSA: 67.43000
• Density: 1.314g/cm³
• LogP: 3.64020
• Storage Temp.: 2-8°C
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 267.0120774
• Heavy Atom Count: 17
• Complexity: 277

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Chloro-phenyl)-thiazole-4-carboxylicacidethylester ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CSC(=N1)C2=CC=CC=C2Cl

Technology Process of Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate

There total 6 articles about Ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate 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: 23.0%

ethyl Bromopyruvate (70-23-5) + 2-chlorothiobenzamide (15717-17-6) → ethyl 4-(2-chlorophenyl)thiazole-2-carboxylate (1050507-06-6) + ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate (132089-36-2)

Guidance literature:

With pyridine; In ethanol; at 150 ℃; for 1.5h; Microwave irradiation;

DOI:10.1002/jhet.1644

Reference yield:

ethyl 2-bromothiazole-4-carboxylate (100367-77-9) + 2-Chlorobenzeneboronic acid (3900-89-8) → ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate (132089-36-2)

Guidance literature:

With sodium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In monoethylene glycol diethyl ether; water; at 80 ℃; for 3h;

Reference yield:

(2-chloro-phenyl)-thioacetic acid amide (673476-96-5) + 2-chlorothiobenzamide (15717-17-6) → ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate (132089-36-2)

Guidance literature:

In ethanol; at 75 ℃;

DOI:10.1016/S0960-894X(03)00726-1

upstream raw materials:

(2-chloro-phenyl)-thioacetic acid amide

2-chlorothiobenzamide

ethyl 2-bromothiazole-4-carboxylate

2-Chlorobenzeneboronic acid

Downstream raw materials:

2-(2-chlorophenyl)-1,3-thiazole-4-carbohydrazide

[2-(2-chlorophenyl)-1,3-thiazol-4-yl]carboxyaldehyde

2-(2-chlorophenyl)-4-hydroxymethylthiazole

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