4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one

Base Information

Chemical Name:4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one
CAS No.:84065-62-3
Molecular Formula:C20H20O4S
Molecular Weight:356.442
Hs Code.:
DSSTox Substance ID:DTXSID70528549

Synonyms:84065-62-3;4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one;DTXSID70528549

Suppliers and Price of 4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one

Supply Marketing:

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

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Chemical Property of 4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:356.10823029
Heavy Atom Count:25
Complexity:590

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(C(CC1=O)COC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Technology Process of 4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-1-one

There total 2 articles about 4-(Benzenesulfonyl)-2-methyl-5-(phenoxymethyl)cyclohex-2-en-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:

: 1746-13-0
allyl phenyl ether

: 84065-62-3
5-(phenoxymethyl)-4-(phenylsulfonyl)-2-methylcyclohex-2-enone

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) 15percent H₂O₂ / 1.) CCl₄, irradiation, 1.5 h, 2.) CH₂Cl₂, 30 min, 0 deg C then 30 min, RT

2: 2.) 1percent HCl / 1.) xylene, reflux, 20 h, 2.) THF, RT, 5 h

With hydrogenchloride; dihydrogen peroxide;
DOI:10.1021/jo00173a040

Reference yield:

: 60805-71-2
phenylselenyl benzenesulfonate

: 84065-62-3
5-(phenoxymethyl)-4-(phenylsulfonyl)-2-methylcyclohex-2-enone

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) 15percent H₂O₂ / 1.) CCl₄, irradiation, 1.5 h, 2.) CH₂Cl₂, 30 min, 0 deg C then 30 min, RT

2: 2.) 1percent HCl / 1.) xylene, reflux, 20 h, 2.) THF, RT, 5 h

With hydrogenchloride; dihydrogen peroxide;
DOI:10.1021/jo00173a040