1-(Furan-2-yl)-5-methylhex-1-en-3-one

Base Information

Chemical Name:1-(Furan-2-yl)-5-methylhex-1-en-3-one
CAS No.:4196-96-7
Molecular Formula:C11H14O2
Molecular Weight:178.231
Hs Code.:
DSSTox Substance ID:DTXSID40294648
Mol file:4196-96-7.mol

Synonyms:4196-96-7;1-(furan-2-yl)-5-methylhex-1-en-3-one;DTXSID40294648;1-(2-furanyl)-5-methyl-1-hexen-3-one

Suppliers and Price of 1-(Furan-2-yl)-5-methylhex-1-en-3-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of 1-(Furan-2-yl)-5-methylhex-1-en-3-one

Chemical Property:

Vapor Pressure:0.00657mmHg at 25°C
Boiling Point:271.1°Cat760mmHg
Flash Point:121°C
Density:1.008g/cm³
XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:178.099379685
Heavy Atom Count:13
Complexity:194

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:CC(C)CC(=O)C=CC1=CC=CO1
General Description (1E)-1-Furan-2-yl-5-methylhex-1-en-3-one is an α,β-unsaturated ketone derived from the aldol condensation of furfural and methyl isobutyl ketone (MIBK). It serves as a key intermediate in the synthesis of furan-derived biofuels, such as branched alkanes (e.g., 2-methylundecane), as well as tetrahydrofuran derivatives and amines (e.g., 1-(furan-2-yl)-4-methylpentan-2-amine). (1E)-1-furan-2-yl-5-methylhex-1-en-3-one is accessible through solvent-free or aqueous catalytic processes and can be further hydrogenated or hydrodeoxygenated to yield valuable pharmaceutical or fuel-related products. Its synthesis is notable for high yields (>90%) and scalability, making it a practical precursor in biomass valorization. **Other names**: - (E)-1-(Furan-2-yl)-5-methylhex-1-en-3-one - 1-(2-Furyl)-5-methyl-1-hexen-3-one (E-form) - Furfurylidene MIBK (less common)

Technology Process of 1-(Furan-2-yl)-5-methylhex-1-en-3-one

There total 5 articles about 1-(Furan-2-yl)-5-methylhex-1-en-3-one 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: 96.0%

: 98-01-1
furfural

: 108-10-1
4-methyl-2-pentanone

: 4196-96-7
1-(2-furyl)-5-methylhex-1-en-3-one

Guidance literature:: With sodium hydroxide; In neat (no solvent); at 50 ℃; for 6h; Sealed tube;
DOI:10.1016/j.apcata.2017.01.017

Reference yield: 78.0%

: 18039-26-4,20787-16-0,20787-21-7,77943-32-9,77943-33-0,89615-43-0,89615-44-1,90899-55-1
2,3,4-tri-O-benzyl-D-xylopyranose

: 108-10-1
4-methyl-2-pentanone

: 4196-96-7
1-(2-furyl)-5-methylhex-1-en-3-one

Guidance literature:: 2,3,4-tri-O-benzyl-D-xylopyranose; 4-methyl-2-pentanone; With tetrabutylammomium bromide; lithium hydroxide; In water; at 60 ℃; for 0.25h;

With hydrogenchloride; In water; at 60 ℃; for 2h;
DOI:10.1039/c4ra14457k