Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate

Base Information

Chemical Name:Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate
CAS No.:81842-29-7
Molecular Formula:C₁₃H₂₀O₃
Molecular Weight:224.3
Hs Code.:
DSSTox Substance ID:DTXSID40528536

Synonyms:Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate;81842-29-7;DTXSID40528536;ethyl 5-(4-oxo-2-cyclohexen-1-yl)pentanoate

Suppliers and Price of Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate

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 1 raw suppliers

Chemical Property of Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:224.14124450
Heavy Atom Count:16
Complexity:268

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:CCOC(=O)CCCCC1CCC(=O)C=C1

Technology Process of Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate

There total 3 articles about Ethyl 5-(4-oxocyclohex-2-en-1-yl)pentanoate 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:

: 41302-32-3
ethyl 5-iodopentanoate

: 81842-29-7
4-(4-carbethoxybutyl)-2-cyclohexenone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaH / 1.) DMF

2: 1.) NaHPO₄, 6percent natrium amalgame, 2.) p-toluenesulfonic acid / 1.) methanol, 1.5 h, 2.) ethanol, water, 19 h, reflux

With sodium amalgam; camphor-10-sulfonic acid; sodium hydride; toluene-4-sulfonic acid;
DOI:10.1021/jo00173a040

Reference yield:

: 81841-89-6
4,4-(ethylenedioxy)-1-(phenylsulfonyl)cyclohexene

: 81842-29-7
4-(4-carbethoxybutyl)-2-cyclohexenone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaH / 1.) DMF

2: 1.) NaHPO₄, 6percent natrium amalgame, 2.) p-toluenesulfonic acid / 1.) methanol, 1.5 h, 2.) ethanol, water, 19 h, reflux

With sodium amalgam; camphor-10-sulfonic acid; sodium hydride; toluene-4-sulfonic acid;
DOI:10.1021/jo00173a040

Reference yield:

: 81841-99-8
6,6-(ethylenedioxy)-3-(4-carbethoxybutyl)-3-(phenylsulfonyl)cyclohexene

: 81842-23-1
4-(4-carbethoxybutyl)-3-cyclohexenone

: 81842-29-7
4-(4-carbethoxybutyl)-2-cyclohexenone

Guidance literature:: With disodium hydrogenphosphate; sodium amalgam; toluene-4-sulfonic acid; Yield given. Multistep reaction. Yields of byproduct given; 1.) methanol, room temp., 30 min, 2.) ethanol, reflux, 20 h;
DOI:10.1016/S0040-4039(00)86766-0