2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-

Base Information

Chemical Name:2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-
CAS No.:294865-06-8
Molecular Formula:C₂₁H₂₇FO
Molecular Weight:314.443
Hs Code.:
DSSTox Substance ID:DTXSID70476773
Nikkaji Number:J1.665.315B

Synonyms:294865-06-8;2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-;DTXSID70476773

Suppliers and Price of 2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-

Chemical Property:

XLogP3:6.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:314.20459364
Heavy Atom Count:23
Complexity:425

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC1CCC(CC1)C2=CC(=O)C(CC2)C3=CC=C(C=C3)F

Technology Process of 2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)-

There total 3 articles about 2-Cyclohexen-1-one, 6-(4-fluorophenyl)-3-(trans-4-propylcyclohexyl)- 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: 52.0%

: 387357-27-9
trans-4-propylcyclohexyl-β-bromoethyl ketone

: 459-03-0
4-fluorophenyl acetone

: 294865-06-8
3-(trans-4-propylcyclohexyl)-6-(4-fluorophenyl)cyclohex-2-en-1-one

Guidance literature:: With potassium hydroxide; In 1,4-dioxane; for 5h; Heating;
DOI:10.1080/10587250108025282

Reference yield:

: 250785-08-1
1-(trans-4-propylcyclohexyl)-1-cyclopropanol

: 294865-06-8
3-(trans-4-propylcyclohexyl)-6-(4-fluorophenyl)cyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / bromine / methanol; H₂O / 0.25 h / 20 °C

2: 52 percent / potassium hydroxide / dioxane / 5 h / Heating

With potassium hydroxide; bromine; In 1,4-dioxane; methanol; water;
DOI:10.1080/10587250108025282

Reference yield:

: ethyl trans-4-propylcyclohexane-carboxylate

: 294865-06-8
3-(trans-4-propylcyclohexyl)-6-(4-fluorophenyl)cyclohex-2-en-1-one

Guidance literature:: Multi-step reaction with 3 steps

1: 100 percent / tetraisopropoxytitanium / diethyl ether / 1 h / 20 °C

2: 90 percent / bromine / methanol; H₂O / 0.25 h / 20 °C

3: 52 percent / potassium hydroxide / dioxane / 5 h / Heating

With titanium(IV) isopropylate; potassium hydroxide; bromine; In 1,4-dioxane; methanol; diethyl ether; water;
DOI:10.1080/10587250108025282