2,5-Dihexylfuran

Base Information

• Chemical Name: 2,5-Dihexylfuran
• CAS No.: 128912-39-0
• Molecular Formula: C16H28O
• Molecular Weight: 236.398
• DSSTox Substance ID: DTXSID60563227
• Nikkaji Number: J3.415.686G
• Wikidata: Q82447606
• Mol file: 128912-39-0.mol

Synonyms:2,5-DIHEXYLFURAN;128912-39-0;DTXSID60563227

Chemical Property of 2,5-Dihexylfuran

Chemical Property:

• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 10
• Exact Mass: 236.214015512
• Heavy Atom Count: 17
• Complexity: 149

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC1=CC=C(O1)CCCCCC

Technology Process of 2,5-Dihexylfuran

There total 5 articles about 2,5-Dihexylfuran 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: 80.0%

n-octyne (629-05-0) + aniline (62-53-3) → 2,5-dihexyl-1-phenyl-1H-pyrrole (1228507-60-5) + 2,5-di(n-hexyl)furan (128912-39-0)

Guidance literature:

With copper(II) acetate monohydrate; In methanol; at 150 ℃; for 0.166667h; Microwave irradiation;

DOI:10.1002/adsc.201500711

Reference yield: 66.0%

n-octyne (629-05-0) + benzylamine (100-46-9) → 1-benzyl-2,5-dihexylpyrrole + 2,5-di(n-hexyl)furan (128912-39-0)

Guidance literature:

With copper(II) acetate monohydrate; In methanol; at 150 ℃; for 0.5h; Microwave irradiation;

DOI:10.1002/adsc.201500711

Reference yield: 62.0%

n-octyne (629-05-0) + cyclohexylamine (108-91-8,157973-60-9) → 1-cyclohexyl-2,5-dihexylpyrrole + 2,5-di(n-hexyl)furan (128912-39-0)

Guidance literature:

With copper(II) acetate monohydrate; In methanol; at 150 ℃; for 1h; Microwave irradiation;

DOI:10.1002/adsc.201500711

upstream raw materials:

n-octyne

phenylacetylene

aniline

benzylamine

Downstream raw materials:

3,6-dihexylphthalonitrile