2-(2-Phenylethanesulfonyl)cyclohexan-1-one

Base Information

Chemical Name:2-(2-Phenylethanesulfonyl)cyclohexan-1-one
CAS No.:89730-00-7
Molecular Formula:C14H18O3S
Molecular Weight:266.361
Hs Code.:
DSSTox Substance ID:DTXSID40520439

Synonyms:89730-00-7;2-(2-Phenylethanesulfonyl)cyclohexan-1-one;DTXSID40520439

Suppliers and Price of 2-(2-Phenylethanesulfonyl)cyclohexan-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 2-(2-Phenylethanesulfonyl)cyclohexan-1-one

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:266.09766561
Heavy Atom Count:18
Complexity:374

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(=O)C(C1)S(=O)(=O)CCC2=CC=CC=C2

Technology Process of 2-(2-Phenylethanesulfonyl)cyclohexan-1-one

There total 3 articles about 2-(2-Phenylethanesulfonyl)cyclohexan-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: 97.0%

: 89730-34-7
2-<(2-Phenylethyl)thio>-1-cyclohexanon

: 89730-00-7
2-(2-Phenylethylsulfonyl)-1-cyclohexanon

Guidance literature:: With sodium hydrogencarbonate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 0 ℃; for 14h;

Reference yield:

: 52190-35-9
2-(methylthio)cyclohexanone

: 89730-00-7
2-(2-Phenylethylsulfonyl)-1-cyclohexanon

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / NaHCO₃, m-ClC₆H₄CO₃H / CH₂Cl₂ / 14 h / 0 °C

2: 1) Nah, HMPTA, BuLi / 1) THF, 2) -90 deg C to RT, 15h

With N,N,N,N,N,N-hexamethylphosphoric triamide; n-butyllithium; sodium hydride; sodium hydrogencarbonate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane;

Reference yield:

: 16096-71-2
2-(Methylsulfonyl)-1-cyclohexanon

: 100-44-7
benzyl chloride

: 89730-00-7
2-(2-Phenylethylsulfonyl)-1-cyclohexanon

Guidance literature:: With N,N,N,N,N,N-hexamethylphosphoric triamide; n-butyllithium; sodium hydride; Yield given. Multistep reaction; 1) THF, 2) -90 deg C to RT, 15h;