1-(Benzenesulfonyl)-3,3-dimethylbutan-2-one

Base Information

Chemical Name:1-(Benzenesulfonyl)-3,3-dimethylbutan-2-one
CAS No.:81023-75-8
Molecular Formula:C12H16O3S
Molecular Weight:240.323
Hs Code.:
European Community (EC) Number:636-013-9
ChEMBL ID:CHEMBL240980
Nikkaji Number:J1.639.879I

Synonyms:CHEMBL240980;3,3-dimethyl-1-(phenylsulfonyl)butan-2-one;1-(benzenesulfonyl)-3,3-dimethylbutan-2-one;SCHEMBL6129827;1-(PHENYLSULFONYL)PINACOLONE;BDBM50212523;AKOS003310254;3,3-dimethyl-1-(phenylsulfonyl)-2-butanone;AP-853/42162480

Suppliers and Price of 1-(Benzenesulfonyl)-3,3-dimethylbutan-2-one

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 1-(Benzenesulfonyl)-3,3-dimethylbutan-2-one

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:240.08201554
Heavy Atom Count:16
Complexity:337

Purity/Quality:: 98%,99%, ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)C(=O)CS(=O)(=O)C1=CC=CC=C1

Technology Process of 1-(Benzenesulfonyl)-3,3-dimethylbutan-2-one

There total 6 articles about 1-(Benzenesulfonyl)-3,3-dimethylbutan-2-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: 85.0%

: 873-55-2
sodium benzenesulfonate

: 5469-26-1
1-Bromopinacolon

: 81023-75-8
3,3-dimethyl-1-(phenylsulfonyl)butan-2-one

Guidance literature:: In N,N-dimethyl-formamide; at 120 ℃; for 0.333333h; microwave irradiation;
DOI:10.1016/j.bmc.2007.04.035

Reference yield: 76.0%

: 72531-41-0
4,4-Dimethyl-3-oxo-pentanoic Acid

: 873-55-2
sodium benzenesulfonate

: 81023-75-8
3,3-dimethyl-1-(phenylsulfonyl)butan-2-one

Guidance literature:: With potassium phosphate; N-Bromosuccinimide; In dichloromethane; at 20 ℃; for 24h; chemoselective reaction; Schlenk technique;
DOI:10.1016/j.tet.2018.08.024