Methyl 2-bromo-5-ethylthiazole-4-carboxylate

Base Information

• Chemical Name: Methyl 2-bromo-5-ethylthiazole-4-carboxylate
• CAS No.: 81569-46-2
• Molecular Formula: C₇H₈BrNO₂S
• Molecular Weight: 250.116
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID00515260
• Wikidata: Q72488492
• Mol file: 81569-46-2.mol

Synonyms:Methyl 2-bromo-5-ethylthiazole-4-carboxylate;81569-46-2;Methyl 2-bromo-5-ethyl-1,3-thiazole-4-carboxylate;MFCD11706992;Methyl2-bromo-5-ethylthiazole-4-carboxylate;SCHEMBL1548833;DTXSID00515260;AMY32172;AKOS015842939;PS-5021;SY034813;CS-0061445;FT-0685639;EN300-1458194;A864533;J-521962

Chemical Property of Methyl 2-bromo-5-ethylthiazole-4-carboxylate

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Boiling Point: 312.625°C at 760 mmHg
• PKA: -1.21±0.10(Predicted)
• Flash Point: 142.871°C
• PSA: 67.43000
• Density: 1.572
• LogP: 2.25460
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 248.94591
• Heavy Atom Count: 12
• Complexity: 179

Purity/Quality:

98%min ^*data from raw suppliers

Methyl 2-bromo-5-ethylthiazole-4-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=C(N=C(S1)Br)C(=O)OC

Technology Process of Methyl 2-bromo-5-ethylthiazole-4-carboxylate

There total 1 articles about Methyl 2-bromo-5-ethylthiazole-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:

methyl 2-amino-5-ethyl-1,3-thiazole-4-carboxylate (28942-54-3) → methyl 2-bromo-5-ethylthiazole-4-carboxylate (81569-46-2)

Guidance literature:

With sulfuric acid; copper(II) sulfate; sodium bromide; sodium nitrite; In water;

Reference yield:

methyl 2-bromo-5-ethylthiazole-4-carboxylate (81569-46-2) → 4-(5-ethyl-4-(methoxycarbonyl)-1,3-thiazol-2-yl)benzoic acid (406235-70-9)

Guidance literature:

upstream raw materials:

methyl 2-amino-5-ethyl-1,3-thiazole-4-carboxylate

Downstream raw materials:

4-(5-ethyl-4-(methoxycarbonyl)-1,3-thiazol-2-yl)benzoic acid

Refernces

• 1、 Barton, Anne,Breukelman, Stephen P.,Kaye, Perry T.,Meakins, G. Denis,Morgan, David J.. "The Preparation of Thiazole-4- and -5-carboxylates, and an Infrared Study of their Rotational Isomers". . p. 159 - 164. Retrieved 2007/10/02.