4-Methyl-4-phenyl-cyclohexa-2,5-dienone

Base Information

Chemical Name:4-Methyl-4-phenyl-cyclohexa-2,5-dienone
CAS No.:28937-18-0
Molecular Formula:C₁₃H₁₂O
Molecular Weight:184.238
Hs Code.:
European Community (EC) Number:683-768-5
DSSTox Substance ID:DTXSID801270363
Nikkaji Number:J3.147.698D

Synonyms:4-METHYL-4-PHENYL-CYCLOHEXA-2,5-DIENONE;SCHEMBL8873990;4-Methyl-4-phenylcyclohexadienone;DTXSID801270363;AKOS024322818;28937-18-0;4-Methyl-4-phenyl-2,5-cyclohexadien-1-one

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

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Chemical Property of 4-Methyl-4-phenyl-cyclohexa-2,5-dienone

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:184.088815002
Heavy Atom Count:14
Complexity:264

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1(C=CC(=O)C=C1)C2=CC=CC=C2

Technology Process of 4-Methyl-4-phenyl-cyclohexa-2,5-dienone

There total 5 articles about 4-Methyl-4-phenyl-cyclohexa-2,5-dienone 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: 11.0%

: 28937-18-0
4-methyl-4-phenyl-cyclohex-2,5-dien-1-one

: 106912-94-1
2-methyl-[1,1’-biphenyl]-3-ol

: 28864-88-2,29472-73-9
6-Methyl-endo-6-phenylbicyclo<3.1.0>hex-3-en-2-on

Guidance literature:: In acetone; Ambient temperature; Irradiation;
DOI:10.1016/S0040-4020(01)81650-1

Reference yield:

: 34713-70-7
2-Phenylpropanal

: 28937-18-0
4-methyl-4-phenyl-cyclohex-2,5-dien-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: KOH, aq. EtOH / diethyl ether

2: DDQ / dioxane

With potassium hydroxide; ethanol; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In 1,4-dioxane; diethyl ether;
DOI:10.1021/ja00712a028

Reference yield:

: 109141-70-0
1-(1-methoxyprop-1-en-2-yl)benzene

: 28937-18-0
4-methyl-4-phenyl-cyclohex-2,5-dien-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: toluene-4-sulfonic acid / toluene / 20 - 100 °C

2: 2,3-dicyano-5,6-dichloro-p-benzoquinone / 1,4-dioxane / 22 h / 100 °C

With toluene-4-sulfonic acid; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In 1,4-dioxane; toluene;
DOI:10.1002/anie.201601636