4-Iodo-1,3-thiazole

Base Information

• Chemical Name: 4-Iodo-1,3-thiazole
• CAS No.: 108306-60-1
• Molecular Formula: C₃H₂INS
• Molecular Weight: 211.026
• European Community (EC) Number: 845-586-6
• Mol file: 108306-60-1.mol

Synonyms:4-iodoThiazole;4-iodo-1,3-thiazole;108306-60-1;4-iodo thiazole;SCHEMBL7885852;CS-0254708;EN300-373995;G62991

Chemical Property of 4-Iodo-1,3-thiazole

Chemical Property:

• Boiling Point: 228.0±13.0 °C(Predicted)
• Density: 2.239±0.06 g/cm3(Predicted)
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 210.89527
• Heavy Atom Count: 6
• Complexity: 50.1

Purity/Quality:

99% ^*data from raw suppliers

4-iodo-1,3-thiazole 95.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(N=CS1)I

Technology Process of 4-Iodo-1,3-thiazole

There total 4 articles about 4-Iodo-1,3-thiazole 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: 100.0%

4-Bromo-2-trimethylsilylthiazole (108306-53-2) → 4-Iodothiazole (108306-60-1)

Guidance literature:

4-Bromo-2-trimethylsilylthiazole; With n-butyllithium; In diethyl ether; hexane; at -78 ℃; for 1h;

With iodine; In diethyl ether; hexane; at -78 ℃; for 0.833333h;

Reference yield: 65.0%

4-bromo-1,3-thiazole (34259-99-9) → 4-Iodothiazole (108306-60-1)

Guidance literature:

With copper(l) iodide; sodium iodide; N,N`-dimethylethylenediamine; In 1,4-dioxane; at 20 - 105 ℃; for 28h;

Reference yield:

4-Bromo-2-trimethylsilylthiazole (108306-53-2) → 4-Iodothiazole (108306-60-1) + 4-Iodo-2-bromothiazole (41731-34-4)

Guidance literature:

Yield given. Multistep reaction. Yields of byproduct given;

DOI:10.1055/s-1986-31766

upstream raw materials:

4-Bromo-2-trimethylsilylthiazole

4-bromo-1,3-thiazole

Downstream raw materials:

C₁₁H₆BrNS

Refernces

• 1、 -. "COMPOUNDS". Page/Page column 33. . Retrieved 2018/12/03.
• 2、 Dondoni, A.,Mastellari, A. R.,Medici, A.,Negrini, E.,Pedrini, P.. "Synthesis of Stannylthiazoles and Mixed Stannylsilylthiazoles and their Use for a Convenient Preparation of Mono- and Bis-halothiazoles". . p. 757 - 760. Retrieved 2007/10/02.