2-(2-Furyl)-1,3-thiazole-4-carboxylic acid

Base Information

• Chemical Name: 2-(2-Furyl)-1,3-thiazole-4-carboxylic acid
• CAS No.: 115299-13-3
• Molecular Formula: C₈H₅NO₃S
• Molecular Weight: 195.199
• Hs Code.: 2934100090
• European Community (EC) Number: 847-998-1
• Mol file: 115299-13-3.mol

Synonyms:2-(2-furyl)-1,3-thiazole-4-carboxylic acid;115299-13-3;2-(furan-2-yl)-1,3-thiazole-4-carboxylic acid;SCHEMBL4983851;HYMZKFYFRXCTCA-UHFFFAOYSA-N;MFCD08235208;AKOS008103632;2-(2-furyl)-4-thiazolecarboxylic acid;2-(2-furyl)-4-thiazole carboxylic acid;2-(Furan-2-yl)thiazole-4-carboxylicacid;TS-00297;2-(Furan-2-yl)thiazole-4-carboxylic acid;CS-0244977;EN300-29757;G22378;J-003278;Z285921578

Chemical Property of 2-(2-Furyl)-1,3-thiazole-4-carboxylic acid

Chemical Property:

• Melting Point: 257-265 °C
• Boiling Point: 410.4±43.0 °C(Predicted)
• PKA: 3.46±0.10(Predicted)
• Density: 1.470±0.06 g/cm3(Predicted)
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 194.99901420
• Heavy Atom Count: 13
• Complexity: 212

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Furyl)-1,3-thiazolidine-4-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=COC(=C1)C2=NC(=CS2)C(=O)O

Technology Process of 2-(2-Furyl)-1,3-thiazole-4-carboxylic acid

There total 2 articles about 2-(2-Furyl)-1,3-thiazole-4-carboxylic acid 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: 98.0%

2-(furan-2-yl)-4-methoxycarbonylthiazole → 2(2-furyl)-4-thiazolecarboxylic acid (115299-13-3)

Guidance literature:

With methanol; potassium carbonate; In water; at 60 ℃; for 3h; Inert atmosphere; Schlenk technique;

DOI:10.1246/bcsj.20170027

Reference yield:

aqueous potassium hydroxide + ethyl 2-(2-furyl)thiazole-4-carboxylate (115299-19-9) → 2(2-furyl)-4-thiazolecarboxylic acid (115299-13-3)

Guidance literature:

In methanol; water;

Reference yield:

2(2-furyl)-4-thiazolecarboxylic acid (115299-13-3) + piperidine-3-carboxylic acid (4-chloro-phenyl)-amide → N-(4-chlorophenyl)-1-(2-(furan-2-yl)thiazole-4-carbonyl)piperidine-3-carboxamide

Guidance literature:

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran;

DOI:10.1016/j.bmcl.2017.02.070

upstream raw materials:

ethyl 2-(2-furyl)thiazole-4-carboxylate