Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-

Base Information

Chemical Name:Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-
CAS No.:104094-47-5
Molecular Formula:C12H8ClNO4S
Molecular Weight:297.719
Hs Code.:
DSSTox Substance ID:DTXSID20478328
Wikidata:Q82311652
Mol file:104094-47-5.mol

Synonyms:104094-47-5;Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-;DTXSID20478328

Suppliers and Price of Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-

Supply Marketing:

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

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Chemical Property of Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:296.9862566
Heavy Atom Count:19
Complexity:422

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Technology Process of Benzene, 1-chloro-4-nitro-2-(phenylsulfonyl)-

There total 4 articles about Benzene, 1-chloro-4-nitro-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: 93.0%

: 851049-56-4
4-chloro-1-nitro-3-(phenylthio)benzene

: 104094-47-5
4-chloro-1-nitro-3-phenylsulfonylbenzene

Guidance literature:: With urea hydrogen peroxide; trifluoroacetic anhydride; In acetonitrile; at 20 ℃;
DOI:10.1081/SCC-200046496

Reference yield:

: 4533-95-3
5-nitro-2-chlorobenzenesulfonyl chloride

: 71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1
benzene

: 104094-47-5
4-chloro-1-nitro-3-phenylsulfonylbenzene

Guidance literature:: With aluminium trichloride;
DOI:10.1039/jr9360000218

Reference yield:

: 16588-26-4
3-bromo-4-chloronitrobenzene

: 104094-47-5
4-chloro-1-nitro-3-phenylsulfonylbenzene

Guidance literature:: Multi-step reaction with 2 steps

1.1: copper(I) oxide / ethanol / Heating

1.2: 80 percent / pyridine; quinoline / 2 h / 220 °C

2.1: 93 percent / urea hydrogen peroxide; trifluoroacetic anhydride / acetonitrile / 20 °C

With copper(I) oxide; urea hydrogen peroxide; trifluoroacetic anhydride; In ethanol; acetonitrile;
DOI:10.1081/SCC-200046496