2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-

Base Information

Chemical Name:2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-
CAS No.:120186-70-1
Molecular Formula:C21H28O
Molecular Weight:296.453
Hs Code.:
DSSTox Substance ID:DTXSID30470075

Synonyms:120186-70-1;2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-;DTXSID30470075

Suppliers and Price of 2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-

Supply Marketing:

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

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Chemical Property of 2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-

Chemical Property:

XLogP3:6.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:296.214015512
Heavy Atom Count:22
Complexity:465

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl-

There total 2 articles about 2,5-Cyclohexadien-1-one, 2,6-bis(1,1-dimethylethyl)-4-methyl-4-phenyl- 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: 60.0%

: 108-86-1,52753-63-6
bromobenzene

: 128-37-0
2,6-di-tert-butyl-4-methyl-phenol

: 120186-70-1
2,6-di-tert.-butyl-4methyl-4-phenylcyclohexa-2,5-dien-1-one

Guidance literature:: With monophosphine 1,2,3,4,5-pentaphenyl-1'-(di-tert-butylphosphino)ferrocene; bis(η3-allyl-μ-chloropalladium(II)); potassium tert-butylate; In toluene; at 120 ℃; for 8h; Schlenk technique; Inert atmosphere;
DOI:10.1002/anie.201608724

Reference yield: 22.0%

: 128-37-0
2,6-di-tert-butyl-4-methyl-phenol

: 120186-71-2
3-(tert-butyl)-5-methyl-[1,1'-biphenyl]-2-ol

: 120186-70-1
2,6-di-tert.-butyl-4methyl-4-phenylcyclohexa-2,5-dien-1-one

Guidance literature:: With N,N,N′,N′-tetramethyl-N″-tert-butylguanidine; In tetrahydrofuran; for 15h; Ambient temperature;
DOI:10.1016/S0040-4020(01)86150-0