5-(Benzenesulfonyl)-5-nitropentan-2-one

Base Information

Chemical Name:5-(Benzenesulfonyl)-5-nitropentan-2-one
CAS No.:122876-03-3
Molecular Formula:C11H13NO5S
Molecular Weight:
Hs Code.:
DSSTox Substance ID:DTXSID80560899
Nikkaji Number:J454.571K
Mol file:122876-03-3.mol

Synonyms:122876-03-3;5-(Benzenesulfonyl)-5-nitropentan-2-one;DTXSID80560899

Suppliers and Price of 5-(Benzenesulfonyl)-5-nitropentan-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 1 raw suppliers

Chemical Property of 5-(Benzenesulfonyl)-5-nitropentan-2-one

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:271.05144369
Heavy Atom Count:18
Complexity:400

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CCC([N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1

Technology Process of 5-(Benzenesulfonyl)-5-nitropentan-2-one

There total 1 articles about 5-(Benzenesulfonyl)-5-nitropentan-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:

: 21272-85-5
phenylsulfonylnitromethane

: 78-94-4,25038-87-3
methyl vinyl ketone

: 122876-03-3
5-nitro-5-(phenylsulfonyl)pentan-2-one

Guidance literature:: With N,N,N,N,N,N-hexamethylphosphoric triamide; potassium fluoride; sodium hydride; Multistep reaction; 1.) THF, 0 deg C, 15 min, 2.) RT;
DOI:10.1021/jo00284a017

Reference yield: 68.0%

: 122876-03-3
5-nitro-5-(phenylsulfonyl)pentan-2-one

: 22020-87-7
5-nitro-2-pentanone

Guidance literature:: With sodium dithionite; potassium carbonate; 1,1′-dioctyl-4,4′-bipyridinium; In dichloromethane; water; at 35 ℃; for 3h;

Reference yield:

: 122876-03-3
5-nitro-5-(phenylsulfonyl)pentan-2-one

: 122875-99-4
5-fluoro-5-nitro-5-(phenylsulfonyl)-2-pentanone

Guidance literature:: With potassium fluoride; perchloryl fluoride; Multistep reaction; 1.) MeOH, RT, 0.5 h, 2.) THF, 0 deg C, 1 h;
DOI:10.1021/jo00284a017