Ethyl 2-fluorothiazole-4-carboxylate

Base Information

• Chemical Name: Ethyl 2-fluorothiazole-4-carboxylate
• CAS No.: 153027-86-2
• Molecular Formula: C6H6FNO2S
• Molecular Weight: 175.184
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID50602275
• Wikidata: Q82499257
• Mol file: 153027-86-2.mol

Synonyms:Ethyl 2-fluorothiazole-4-carboxylate;153027-86-2;ethyl 2-fluoro-1,3-thiazole-4-carboxylate;MFCD18416559;Ethyl2-Fluorothiazole-4-carboxylate;SCHEMBL9268196;DTXSID50602275;AC2296;AKOS016008041;DS-18028;SY023346;DB-124775;CS-0151681;EN300-7063245

Chemical Property of Ethyl 2-fluorothiazole-4-carboxylate

Chemical Property:

• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 175.01032777
• Heavy Atom Count: 11
• Complexity: 156

Purity/Quality:

97% ^*data from raw suppliers

Ethyl2-fluorothiazole-4-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CSC(=N1)F

Technology Process of Ethyl 2-fluorothiazole-4-carboxylate

There total 1 articles about Ethyl 2-fluorothiazole-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:

2-chloro-thiazole-4-carboxylic acid ethyl ester (41731-52-6) → ethyl 2-fluorothiazole-4-carboxylate (153027-86-2)

Guidance literature:

With potassium fluoride; In dimethyl sulfoxide;

Reference yield: 80.0%

ethyl 2-fluorothiazole-4-carboxylate (153027-86-2) + 4-((5-(cyclopropylmethyl)-3-((2-(trimethylsilyl)ethoxy)methoxy)-1H-pyrazol-4-yl)methyl)-2-fluoro-N,N-bis(4-methoxybenzyl)benzenesulfonamide → ethyl 2-(4-(4-(N,N-bis(4-methoxybenzyl)sulfamoyl)-3-fluorobenzyl)-5-(cyclopropylmethyl)-3-((2-(trimethylsilyl)ethoxy)methoxy)-1H-pyrazol-1-yl)thiazole-4-carboxylate

Guidance literature:

4-((5-(cyclopropylmethyl)-3-((2-(trimethylsilyl)ethoxy)methoxy)-1H-pyrazol-4-yl)methyl)-2-fluoro-N,N-bis(4-methoxybenzyl)benzenesulfonamide; With sodium tert-pentoxide; In N,N-dimethyl-formamide; for 0.0833333h; Inert atmosphere; Cooling with ice;

ethyl 2-fluorothiazole-4-carboxylate; In N,N-dimethyl-formamide; at 23 ℃; for 0.583333h; Inert atmosphere; Cooling with ice;

With sodium tert-pentoxide; In N,N-dimethyl-formamide; at 23 ℃; for 0.583333h; Inert atmosphere; Cooling with ice;

Reference yield: 62.0%

ethyl 2-fluorothiazole-4-carboxylate (153027-86-2) + 4-((3-(3-bromo-4-fluorophenyl)-5-ethyl-1H-pyrazol-4-yl)methyl)-N,N-bis(4-methoxybenzyl)benzenesulfonamide → ethyl 2-(4-(4-(N,N-bis(4-methoxybenzyl)sulfamoyl)benzyl)-3-(3-bromo-4-fluorophenyl)-5-ethyl-1H-pyrazol-1-yl)thiazole-4-carboxylate

Guidance literature:

4-((3-(3-bromo-4-fluorophenyl)-5-ethyl-1H-pyrazol-4-yl)methyl)-N,N-bis(4-methoxybenzyl)benzenesulfonamide; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; for 0.166667h;

ethyl 2-fluorothiazole-4-carboxylate; In N,N-dimethyl-formamide; mineral oil; at 0 - 23 ℃; for 1h;

upstream raw materials:

2-chloro-thiazole-4-carboxylic acid ethyl ester

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