3-Methyl-5-hexyl-2-cyclohexen-1-one

Base Information

Chemical Name:3-Methyl-5-hexyl-2-cyclohexen-1-one
CAS No.:3720-17-0
Molecular Formula:C₁₃H₂₂O
Molecular Weight:194.317
Hs Code.:2914299000
DSSTox Substance ID:DTXSID50501299
Mol file:3720-17-0.mol

Synonyms:3-METHYL-5-HEXYL-2-CYCLOHEXEN-1-ONE;3720-17-0;5-hexyl-3-methylcyclohex-2-en-1-one;2-Cyclohexen-1-one,5-hexyl-3-methyl-;SCHEMBL15526449;DTXSID50501299;3-methyl-5-hexyl-2-cyclohexenone;AKOS006331610

Suppliers and Price of 3-Methyl-5-hexyl-2-cyclohexen-1-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

American Custom Chemicals Corporation
3-METHYL-5-HEXYL-2-CYCLOHEXEN-1-ONE 95.00%
5MG
$ 499.81

Total 7 raw suppliers

Chemical Property of 3-Methyl-5-hexyl-2-cyclohexen-1-one

Chemical Property:

Boiling Point:286.2oC at 760mmHg
Flash Point:123.5oC
PSA：17.07000
Density:0.892 g/cm3
LogP:3.88220
XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:194.167065321
Heavy Atom Count:14
Complexity:215

Purity/Quality:

99% ^*data from raw suppliers

3-METHYL-5-HEXYL-2-CYCLOHEXEN-1-ONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCC1CC(=CC(=O)C1)C

Technology Process of 3-Methyl-5-hexyl-2-cyclohexen-1-one

There total 5 articles about 3-Methyl-5-hexyl-2-cyclohexen-1-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:

: 24079-97-8
6-hexyl-2-methyl-4-oxo-cyclohex-2-enecarboxylic acid ethyl ester

: 3720-17-0
3-methyl-5-hexylcyclohex-2-en-1-one

Guidance literature:: With sodium hydroxide; Ansaeuern mit wss. H₂SO₄ und Erhitzen auf Siedetemperatur;
DOI:10.1021/jo01188a008

Reference yield:

: 111-71-7
heptanal

: 3720-17-0
3-methyl-5-hexylcyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: (i) piperidine, (ii) (heating)

2: aq. H₂SO₄ / acetic acid

With sulfuric acid; In acetic acid;
DOI:10.1039/P19790001837

Reference yield:

: 2,4-diacetyl-3-hexyl-glutaric acid diethyl ester

: 3720-17-0
3-methyl-5-hexylcyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: acetic acid; sulfuric acid

2: aq.-ethanolic NaOH / Ansaeuern mit wss. H₂SO₄ und Erhitzen auf Siedetemperatur

With sodium hydroxide; sulfuric acid; acetic acid;
DOI:10.1021/jo01188a008