5-Methyl-4-hexen-3-one

Base Information Edit

Chemical Name:5-Methyl-4-hexen-3-one
CAS No.:13905-10-7
Molecular Formula:C7H12O
Molecular Weight:112.172
Hs Code.:2914190090
NSC Number:82355
DSSTox Substance ID:DTXSID90292412
Nikkaji Number:J110.418G
Mol file:13905-10-7.mol

Synonyms:5-Methyl-4-hexen-3-one;5-methylhex-4-en-3-one;13905-10-7;4-Hexen-3-one, 5-methyl-;NSC82355;5-methyl-4-hexene-3-one;5-Methyl-hex-4-en-3-one;SCHEMBL566255;5-Methyl-4-hexen-3-one #;DTXSID90292412;WNZISGSGRPIJFX-UHFFFAOYSA-N;NSC-82355;AKOS017730240

Suppliers and Price of 5-Methyl-4-hexen-3-one

Supply Marketing:Edit

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 8 raw suppliers

Chemical Property of 5-Methyl-4-hexen-3-one Edit

Chemical Property:

Vapor Pressure:2.86mmHg at 25°C
Boiling Point:156.7°C at 760 mmHg
Flash Point:45.7°C
PSA：17.07000
Density:0.833g/cm³
LogP:1.93170
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:112.088815002
Heavy Atom Count:8
Complexity:108

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(=O)C=C(C)C
Use Description 5-Methyl-4-hexen-3-one, a chemical compound, has several applications in different fields. In the fragrance and flavor industry, it plays a significant role as a key aroma compound, contributing to the pleasant scents and tastes of various consumer products, such as perfumes, colognes, and food flavorings. This compound's fruity and citrusy aroma is particularly desirable for creating appealing fragrances and flavors. In organic synthesis, it serves as a valuable building block for the creation of more complex molecules, making it an essential reagent in the field of chemistry. Its versatile nature and distinctive scent make 5-Methyl-4-hexen-3-one a crucial component in both the fragrance and flavor industry and the realm of organic chemistry, contributing to the development of a wide range of products and chemical compounds.

Technology Process of 5-Methyl-4-hexen-3-one

There total 28 articles about 5-Methyl-4-hexen-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: 50.0%

: 123-62-6
propionic acid anhydride

: 75-65-0
tert-butyl alcohol

: 54119-31-2
diethyl-2,6-methyl-4-pyridine

: 13905-10-7
5-methyl-4-hexen-3-one

: 20487-40-5
tert-butyl propionate

: 109749-63-5
dihydro-2,3-ethyl-6-trimethyl-2,2,5-pyrone-4

Guidance literature:: With ammonium hydroxide; methanesulfonic acid; at 85 ℃; Further byproducts given;

Reference yield: 50.0%

: 123-62-6
propionic acid anhydride

: 75-65-0
tert-butyl alcohol

: 54119-31-2
diethyl-2,6-methyl-4-pyridine

: 13905-10-7
5-methyl-4-hexen-3-one

: 64861-88-7
methyl-5-hexene-5-one-3

: 109749-63-5
dihydro-2,3-ethyl-6-trimethyl-2,2,5-pyrone-4

Guidance literature:: With methanesulfonic acid; at 85 ℃; Further byproducts given;

Reference yield: 42.0%

: 3350-78-5
3,3-Dimethylacryloyl chloride

: 74-96-4
ethyl bromide

: 13905-10-7
5-methyl-4-hexen-3-one

Guidance literature:: ethyl bromide; With magnesium; In tetrahydrofuran;

3,3-Dimethylacryloyl chloride; iron(III) chloride; In tetrahydrofuran; toluene; at -40 ℃; for 6h; Cooling with acetone-dry ice;

With hydrogenchloride; water; In tetrahydrofuran; toluene;