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

Base Information

• Chemical Name: Ethyl 4-(4-bromophenyl)thiazole-2-carboxylate
• CAS No.: 53101-02-3
• Molecular Formula: C12H10BrNO2S
• Molecular Weight: 312.187
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID30356441
• Wikidata: Q82135770
• Mol file: 53101-02-3.mol

Synonyms:53101-02-3;ETHYL 4-(4-BROMOPHENYL)THIAZOLE-2-CARBOXYLATE;2-Thiazolecarboxylic acid, 4-(4-bromophenyl)-, ethyl ester;ethyl 4-(4-bromophenyl)-1,3-thiazole-2-carboxylate;ETHYL 4-(4-BROMOPHENYL)-2-THIAZOLE CARBOXYLATE;MFCD01924838;2-Thiazolecarboxylic acid,4-(4-bromophenyl)-,ethyl ester;DTXSID30356441;AKOS010644148;AB10522;AS-32448;SY012417;CS-0312986;FT-0729060;A870823;AB-601/30966047;ETHYL4-(4-BROMOPHENYL)THIAZOLE-2-CARBOXYLATE;2-Thiazolecarboxylic acid, 4-(4-bromophenyl)-, ethyl2-Thiazolecarboxylic acid, 4-(4-bromophenyl)-, ethylester

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

Chemical Property:

• Vapor Pressure: 4.51E-07mmHg at 25°C
• Refractive Index: 1.602
• Boiling Point: 414.2°C at 760 mmHg
• Flash Point: 204.3°C
• PSA: 67.43000
• Density: 1.5g/cm³
• LogP: 3.74930
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 310.96156
• Heavy Atom Count: 17
• Complexity: 269

Purity/Quality:

97% ^*data from raw suppliers

Ethyl4-(4-Bromophenyl)thiazole-2-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NC(=CS1)C2=CC=C(C=C2)Br
• Uses: Ethyl 4-(4-Bromophenyl)thiazole-2-carboxylate is useful reactant for the synthesis of N,?N-?disubstituted-?4-?arylthiazole-?2-?methylamine derivatives as cholesteryl ester transfer inhibitors.

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

There total 3 articles about Ethyl 4-(4-bromophenyl)thiazole-2-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:

ethyl 2-amino-2-thioxoacetate (16982-21-1) + para-bromophenacyl bromide (99-73-0,132309-76-3) → 4-p-Brom-phenyl-2-carbethoxy-thiazol (53101-02-3)

Guidance literature:

In ethanol; for 6h; Reflux;

DOI:10.3390/molecules22111925

Reference yield:

ethyl 2-amino-2-thioxoacetate (16982-21-1) + para-bromoacetophenone (99-90-1) → 4-p-Brom-phenyl-2-carbethoxy-thiazol (53101-02-3)

Guidance literature:

In ethanol; for 0.5h; Heating;

DOI:10.1039/P19810002335

Reference yield:

→ 4-p-Brom-phenyl-2-carbethoxy-thiazol (53101-02-3)

Guidance literature:

p-Brom-ω-brom-acetophenon, Thiooxamethan;

upstream raw materials:

ethyl 2-amino-2-thioxoacetate

para-bromoacetophenone

para-bromophenacyl bromide

Downstream raw materials:

4-(4-Bromo-phenyl)-2-chloromethyl-thiazole

4-(4-Bromo-phenyl)-thiazole-2-carboxylic acid methyl ester

4-(4-Bromo-phenyl)-thiazole-2-carboxylic acid