2-methyl-5-propylfuran

Base Information

• Chemical Name: 2-methyl-5-propylfuran
• CAS No.: 1456-16-2
• Molecular Formula: C8H12O
• Molecular Weight: 124.183
• DSSTox Substance ID: DTXSID10409328
• Nikkaji Number: J2.476.891K
• Mol file: 1456-16-2.mol

Synonyms:2-methyl-5-propylfuran;1456-16-2;Furan, 2-methyl-5-propyl-;2-methyl-5-propanylfuran;SCHEMBL3723023;DTXSID10409328;XPYQVFYTBQVKIS-UHFFFAOYSA-N;AKOS006278933

Chemical Property of 2-methyl-5-propylfuran

Chemical Property:

• Vapor Pressure: 6.46mmHg at 25°C
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 124.088815002
• Heavy Atom Count: 9
• Complexity: 80.6

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC1=CC=C(O1)C

Technology Process of 2-methyl-5-propylfuran

There total 2 articles about 2-methyl-5-propylfuran 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:

1-propylpent-2-yne-1,4-diol (35336-45-9) + phenethylamine (64-04-0) → 2-methyl-5-propylfuran (1456-16-2) + 2-methyl-1-phenethyl-5-propyl-1H-pyrrole

Guidance literature:

With 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In toluene; for 24h; Title compound not separated from byproducts.; Heating;

DOI:10.1016/j.tetlet.2007.05.070

Reference yield:

1-propylpent-2-yne-1,4-diol (35336-45-9) → 2-methyl-5-propylfuran (1456-16-2) + octane-2,5-dione (3214-41-3)

Guidance literature:

With benzoic acid; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In toluene; at 110 ℃; for 24h; Title compound not separated from byproducts.;

DOI:10.1016/j.tetlet.2007.05.069

Reference yield: 49.0%

2-methyl-5-propylfuran (1456-16-2) → 2-methyl-5-propyl-thiophene (33933-73-2)

Guidance literature:

With hydrogenchloride; hydrogen sulfide; at 35 ℃;

DOI:10.1007/BF00471795

upstream raw materials:

1-propylpent-2-yne-1,4-diol

phenethylamine

Downstream raw materials:

2-methyl-5-propyl-thiophene

octane-2,5-dione

Refernces

• 1、 Pridmore, Simon J.,Slatford, Paul A.,Williams, Jonathan M.J.. "2,5-Disubstituted furans from 1,4-alkynediols". . p. 5111 - 5114. Retrieved 2008/02/09.