3-Hexyl-2-iodothiophene

Base Information

• Chemical Name: 3-Hexyl-2-iodothiophene
• CAS No.: 124561-55-3
• Molecular Formula: C10H15IS
• Molecular Weight: 294.2
• DSSTox Substance ID: DTXSID50573193
• Nikkaji Number: J1.511.533E
• Wikidata: Q82461803
• Mol file: 124561-55-3.mol

Synonyms:3-hexyl-2-iodothiophene;124561-55-3;SCHEMBL8211433;DTXSID50573193

Chemical Property of 3-Hexyl-2-iodothiophene

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 293.99392
• Heavy Atom Count: 12
• Complexity: 116

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC1=C(SC=C1)I

Technology Process of 3-Hexyl-2-iodothiophene

There total 2 articles about 3-Hexyl-2-iodothiophene 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: 93.0%

3-hexyl-2-bromothiophene (69249-61-2,125321-66-6) → 3-Hexyl-2-iodothiophene (124561-55-3)

Guidance literature:

With copper(l) iodide; lithium iodide; In dimethyl sulfoxide; at 150 ℃; for 25h; Inert atmosphere;

DOI:10.1021/ol900622h

Reference yield: 16.0%

3-hexylthiophene (1693-86-3) → 3-Hexyl-2-iodothiophene (124561-55-3) + 2-chloro-3-(n-hexyl)-thiophene (817181-75-2)

Guidance literature:

With N-chloro-succinimide; sodium iodide; In acetic acid; at 20 ℃; for 2h;

DOI:10.1016/j.tetlet.2009.12.125

Reference yield: 80.0%

3-Hexyl-2-iodothiophene (124561-55-3) → 3,3'-dihexyl-2,2'-bithiophene (125607-30-9)

Guidance literature:

With indium; palladium 10% on activated carbon; tetrabutylammomium bromide; lithium chloride; In water; at 90 ℃; for 24h; Reagent/catalyst; Solvent; Catalytic behavior; Green chemistry;

DOI:10.1039/c5ra13517f

upstream raw materials:

3-hexyl-2-bromothiophene

3-hexylthiophene

Downstream raw materials:

3,4'-dihexyl-2,2'-bithiophene

3,3'-dihexyl-2,2'-bithiophene