Ethyl thiazole-2-carboxylate

Base Information

• Chemical Name: Ethyl thiazole-2-carboxylate
• CAS No.: 14527-42-5
• Molecular Formula: C6H7NO2S
• Molecular Weight: 157.193
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID80515788
• Wikidata: Q82376863
• Mol file: 14527-42-5.mol

Synonyms:ETHYL THIAZOLE-2-CARBOXYLATE;14527-42-5;ethyl 1,3-thiazole-2-carboxylate;2-THIAZOLECARBOXYLIC ACID, ETHYL ESTER;THIAZOLE-2-CARBOXYLIC ACID ETHYL ESTER;MFCD06204689;Ethylthiazole-2-carboxylate;2-Thiazolecarboxylicacid, ethyl ester;ethoxycarbonyl thiazole;Ethyl 2-thiazolecarboxylate;SCHEMBL837325;DTXSID80515788;MVMPKHJUPNWMDZ-UHFFFAOYSA-N;AMY20513;2-Thiazolecarboxylicacid,ethyl ester;AKOS010644208;AB23232;DS-17199;SY006151;CS-0097915;FT-0697693;A808343;W-205619

Chemical Property of Ethyl thiazole-2-carboxylate

Chemical Property:

• Boiling Point: 226.525 °C at 760 mmHg
• Flash Point: 90.8 °C
• PSA: 67.43000
• Density: 1.242 g/cm³
• LogP: 1.31980
• Storage Temp.: 2-8°C
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 157.01974964
• Heavy Atom Count: 10
• Complexity: 129

Purity/Quality:

98%min ^*data from raw suppliers

EthylThiazole-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

Technology Process of Ethyl thiazole-2-carboxylate

There total 4 articles about Ethyl 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: 99.0%

2-(trimethylsilyl)thiazole (79265-30-8) + chloroformic acid ethyl ester (541-41-3) → thiazole-2-carboxylic acid ethyl ester (14527-42-5)

Guidance literature:

2-(trimethylsilyl)thiazole; chloroformic acid ethyl ester; In toluene; at 22 ℃; for 2.25h;

With water; sodium carbonate; In toluene; for 0.5h;

Reference yield: 15.0%

2-(trimethylsilyl)thiazole (79265-30-8) + chloroformic acid ethyl ester (541-41-3) → thiazole-2-carboxylic acid ethyl ester (14527-42-5) + Thiazol-2-yl thiazoline (87636-26-8)

Guidance literature:

In benzene; for 20h; Ambient temperature;

DOI:10.1021/jo00243a029

Reference yield: 15.0%

2-(trimethylsilyl)thiazole (79265-30-8) + chloroformic acid ethyl ester (541-41-3) → thiazole-2-carboxylic acid ethyl ester (14527-42-5) + 3λ5-[2,2']Bithiazolyl-3-carboxylic acid ethyl ester

Guidance literature:

In benzene; for 20h; Ambient temperature;

DOI:10.1016/S0040-4039(00)88054-5

upstream raw materials:

2-chloroethanal

ethyl 2-amino-2-thioxoacetate

acetic anhydride

2-(trimethylsilyl)thiazole

Downstream raw materials:

N-(1-methyl-1-phenylethyl)thiazole-2-carboxamide

N,N-diethyl-4-methoxy-2-(2-oxo-2-thiazol-2-yl-ethyl)-benzamide

Refernces

• 1、 -. "Substituted pyrrole chromone compound or pharmaceutically acceptable salt thereof and preparation method and application thereof". Paragraph 0081; 0108-0111. . Retrieved 2019/01/23.
• 2、 -. "THIAZOLE PYRAZOLOPYRIMIDINES AS CRF1 RECEPTOR ANTAGONISTS". Page/Page column 26. . Retrieved 2008/06/13.