Hepta-3,5-dien-2-one

Base Information

Chemical Name:Hepta-3,5-dien-2-one
CAS No.:3916-64-1
Molecular Formula:C7H10 O
Molecular Weight:110.156
Hs Code.:2914199090
DSSTox Substance ID:DTXSID801032050
Mol file:3916-64-1.mol

Synonyms:Hepta-3,5-dien-2-one;heptadienone;5-Acetyl-2,4-pentadiene;DTXSID801032050;FT-0773355;H0022;D90780

Suppliers and Price of Hepta-3,5-dien-2-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

TRC
2,4-Heptadien-6-one
100mg
$ 65.00

TCI Chemical
2,4-Heptadien-6-one (stabilized with HQ) >95.0%(GC)
5g
$ 407.00

American Custom Chemicals Corporation
2,4-HEPTADIEN-6-ONE 95.00%
5MG
$ 504.20

AK Scientific
2,4-Heptadien-6-one
5g
$ 587.00

Total 8 raw suppliers

Chemical Property of Hepta-3,5-dien-2-one

Chemical Property:

Vapor Pressure:1.26mmHg at 25°C
Refractive Index:1.5180 to 1.5220
Boiling Point:88 °C / 29mmHg
Flash Point:56.3°C
PSA：17.07000
Density:0.90
LogP:1.70770
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:110.073164938
Heavy Atom Count:8
Complexity:120

Purity/Quality:

98% ^*data from raw suppliers

2,4-Heptadien-6-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC=CC=CC(=O)C

Technology Process of Hepta-3,5-dien-2-one

There total 3 articles about Hepta-3,5-dien-2-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:

: 32775-95-4
(E)-3,5-hexadienoic acid

: 3916-64-1
hepta-3,5-dien-2-one

: 94291-57-3
(E)-hepta-4,6-dien-2-one

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine; dmap; dicyclohexyl-carbodiimide / dichloromethane / 16 h / 0 - 20 °C

2: tetrahydrofuran / 16 h / -40 °C

With dmap; triethylamine; dicyclohexyl-carbodiimide; In tetrahydrofuran; dichloromethane;
DOI:10.1002/anie.201908693

Reference yield:

: 110-44-1,91751-55-2
sorbic Acid

: 3916-64-1
hepta-3,5-dien-2-one

: 94291-57-3
(E)-hepta-4,6-dien-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: n-butyllithium; diisopropylamine / tetrahydrofuran / 1 h / -10 - 20 °C

2: triethylamine; dmap; dicyclohexyl-carbodiimide / dichloromethane / 16 h / 0 - 20 °C

3: tetrahydrofuran / 16 h / -40 °C

With dmap; n-butyllithium; triethylamine; diisopropylamine; dicyclohexyl-carbodiimide; In tetrahydrofuran; dichloromethane;
DOI:10.1002/anie.201908693