4-(2-Propenyl)-2-cyclohexen-1-one

Base Information

Chemical Name:4-(2-Propenyl)-2-cyclohexen-1-one
CAS No.:4166-61-4
Molecular Formula:C9H12O
Molecular Weight:136.194
Hs Code.:2914299000
DSSTox Substance ID:DTXSID10449502
Mol file:4166-61-4.mol

Synonyms:4-(2-PROPENYL)-2-CYCLOHEXEN-1-ONE;4166-61-4;4-prop-2-enylcyclohex-2-en-1-one;4-Allylcyclohex-2-enone;4-allyl-2-cyclohexen-1-one;4-Allyl-2-cyclohexenone;4-allyl-cyclohex-2-en-1-one;SCHEMBL3222910;DTXSID10449502;NXCVYYZJFBZNPQ-UHFFFAOYSA-N;4-(2-propenyl)cyclohex-2-en-1-one;AKOS006278390;4-(prop-2-en-1-yl)cyclohex-2-en-1-one;FT-0694695;(+/-)-4-(2-propenyl)-2-cyclohexen-1-one;(+/-)-4-(2-propenyl)-2-cyclohexen-l-one

Suppliers and Price of 4-(2-Propenyl)-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

TRC
4-Allyl-2-cyclohexenone
250mg
$ 215.00

Matrix Scientific
4-(2-Propenyl)-2-cyclohexen-1-one
1g
$ 945.00

Matrix Scientific
4-(2-Propenyl)-2-cyclohexen-1-one
500mg
$ 616.00

Matrix Scientific
4-(2-Propenyl)-2-cyclohexen-1-one
5g
$ 3465.00

American Custom Chemicals Corporation
4-(2-PROPENYL)-2-CYCLOHEXEN-1-ONE 98.00%
1G
$ 1703.63

AK Scientific
4-(2-Propenyl)-2-cyclohexen-1-one
250mg
$ 413.00

Total 3 raw suppliers

Chemical Property of 4-(2-Propenyl)-2-cyclohexen-1-one

Chemical Property:

PSA：17.07000
LogP:2.09780
XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:136.088815002
Heavy Atom Count:10
Complexity:168

Purity/Quality:: 4-Allyl-2-cyclohexenone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CCC1CCC(=O)C=C1
Uses 4-Allyl-2-cyclohexenone is an intermediate in the preparation of CB1 and CB2 receptor agonists such as CP-55,940 (C781410).

Technology Process of 4-(2-Propenyl)-2-cyclohexen-1-one

There total 7 articles about 4-(2-Propenyl)-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: 78.0%

: 58775-54-5
(+/-)-3-ethoxy-6-(prop-2-enyl)-cyclohex-2-en-1-one

: 4166-61-4
4-allyl-2-cyclohexenone

Guidance literature:: (+/-)-3-ethoxy-6-(prop-2-enyl)-cyclohex-2-en-1-one; With lithium aluminium tetrahydride; In diethyl ether; for 1h;

With hydrogenchloride; In diethyl ether; for 0.5h; Further stages.;
DOI:10.1016/j.bmc.2007.09.033

Reference yield:

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

: 4166-61-4
4-allyl-2-cyclohexenone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) NaH / 1.) DMF, 2.) 3.5 h

2: 1.) NaHPO₄, 6percent natrium amalgame, 2.) p-toluenesulfonic acid / 1.) methanol, 30 min, 2.) ethanol, water, 11 h, reflux

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

Reference yield:

: 4-allyl-1-trimethylsilyloxylbicyclo<3.1.0>hexane

: 4166-61-4
4-allyl-2-cyclohexenone

Guidance literature:: With sodium acetate; iron(III) chloride; Yield given. Multistep reaction; 1.) DMF, 0 deg C; 2.) MeOH;
DOI:10.1016/S0040-4039(00)79311-7