3-Heptyldihydro-5-methyl-2(3H)-furanone

Base Information

• Chemical Name: 3-Heptyldihydro-5-methyl-2(3H)-furanone
• CAS No.: 40923-64-6
• Molecular Formula: C12H22O2
• Molecular Weight: 198.305
• Hs Code.: 2932209090
• European Community (EC) Number: 255-141-2
• UNII: B5Z5UJR56Z
• DSSTox Substance ID: DTXSID80866025
• Nikkaji Number: J294.790K
• Wikidata: Q27274411
• Metabolomics Workbench ID: 47940
• Mol file: 40923-64-6.mol

Synonyms:3-Heptyldihydro-5-methyl-2(3H)-furanone;40923-64-6;3-heptyl-5-methyloxolan-2-one;FEMA No. 3350;3-Heptyldihydro-5-methylfuran-2(3H)-one;2(3H)-Furanone, 3-heptyldihydro-5-methyl-;alpha-Heptyl-gamma-valerolactone;UNII-B5Z5UJR56Z;B5Z5UJR56Z;EINECS 255-141-2;SCHEMBL3504590;FEMA 3350;DTXSID80866025;CHEBI:171832;AKOS006279437;3-heptyl-5-methyldihydro-2(3H)-furanone;.ALPHA.-HEPTYL-.GAMMA.-VALEROLACTONE;3-Heptyl-5-methyl-4,5-dihydro-2(3H)-furanone;Q27274411;3-HEPTYLDIHYDRO-5-METHYL-2(3H)-FURANONE [FHFI];(+/-)-3-HEPTYLDIHYDRO-5-METHYL-2(3H)-FURANONE

Chemical Property of 3-Heptyldihydro-5-methyl-2(3H)-furanone

Chemical Property:

• Vapor Pressure: 0.00217mmHg at 25°C
• Boiling Point: 289.7°Cat760mmHg
• Flash Point: 117.1°C
• PSA: 26.30000
• Density: 0.916g/cm³
• LogP: 3.29850
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 198.161979940
• Heavy Atom Count: 14
• Complexity: 177

Purity/Quality:

99% ^*data from raw suppliers

3-HEPTYLDIHYDRO-5-METHYL-2(3H)-FURANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC1CC(OC1=O)C
• Description: Heptyl formate has a fruity-floral odor with an orris-rose undertone and a sweet taste reminiscent of plum. May be synthesized from n-heptyl bromide and formamide at the boil.
• Uses: 3-Heptyldihydro-5-methyl-2(3H)-furanone is used in the methods and compositions for modifying sensorial perception associated with transient sensory receptors TRPA1, TRPV1, and TRPA1V1.

Technology Process of 3-Heptyldihydro-5-methyl-2(3H)-furanone

There total 2 articles about 3-Heptyldihydro-5-methyl-2(3H)-furanone 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:

→ 3-heptyldihydro-5-methyl-2(3H)-furanone (40923-64-6)

Guidance literature:

With sulfuric acid;

Reference yield:

→ 3-heptyldihydro-5-methyl-2(3H)-furanone (40923-64-6) + (Z)-α-heptylidene-γ-valerolactone

Guidance literature:

Refernces