2-Cyclohexen-1-one, 2-(phenylsulfonyl)-

Base Information

Chemical Name:2-Cyclohexen-1-one, 2-(phenylsulfonyl)-
CAS No.:169691-01-4
Molecular Formula:C12H12O3S
Molecular Weight:236.291
Hs Code.:
DSSTox Substance ID:DTXSID70472376
Nikkaji Number:J681.031D
Wikidata:Q82301281
Mol file:169691-01-4.mol

Synonyms:169691-01-4;2-Cyclohexen-1-one, 2-(phenylsulfonyl)-;DTXSID70472376

Suppliers and Price of 2-Cyclohexen-1-one, 2-(phenylsulfonyl)-

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of 2-Cyclohexen-1-one, 2-(phenylsulfonyl)-

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:236.05071541
Heavy Atom Count:16
Complexity:395

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC=C(C(=O)C1)S(=O)(=O)C2=CC=CC=C2

Technology Process of 2-Cyclohexen-1-one, 2-(phenylsulfonyl)-

There total 4 articles about 2-Cyclohexen-1-one, 2-(phenylsulfonyl)- 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: 81.0%

: 84978-80-3
2-(phenylsulfinyl)cyclohex-2-en-1-one

: 169691-01-4
2-(Phenylsulfonyl)-2-cyclohexenone

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 0 - 20 ℃; for 4h;
DOI:10.1021/ol400934c

Reference yield:

: 23740-61-6
2-(phenylsulfanyl)-2-cyclohexanone

: 169691-01-4
2-(Phenylsulfonyl)-2-cyclohexenone

Guidance literature:: Multi-step reaction with 2 steps

1: 80 percent / aq. NaIO₄ / methanol / 16 h / Ambient temperature

2: 80 percent / m-CPBA / CH₂Cl₂ / 23 h / Ambient temperature

With sodium periodate; 3-chloro-benzenecarboperoxoic acid; In methanol; dichloromethane;
DOI:10.1021/jo00121a035

Reference yield:

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 169691-01-4
2-(Phenylsulfonyl)-2-cyclohexenone

Guidance literature:: Multi-step reaction with 3 steps

1: acetonitrile / 0 - 20 °C / Inert atmosphere

2: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 2 h / -78 °C

3: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 4 h / 0 - 20 °C

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; acetonitrile;
DOI:10.1021/ol400934c