1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene

Base Information

Chemical Name:1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene
CAS No.:89303-44-6
Molecular Formula:C13H10N2O6S
Molecular Weight:322.298
Hs Code.:
DSSTox Substance ID:DTXSID70532409
Wikidata:Q82404981

Synonyms:89303-44-6;1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene;2,4-dinitrobenzyl phenyl sulfone;DTXSID70532409

Suppliers and Price of 1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:322.02595722
Heavy Atom Count:22
Complexity:512

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)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene

There total 3 articles about 1-[(Benzenesulfonyl)methyl]-2,4-dinitrobenzene 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%

: 99-65-0
meta-dinitrobenzene

: 7205-98-3
chloromethyl phenyl sulfone

: 89303-44-6
1-Benzenesulfonylmethyl-2,4-dinitro-benzene

Guidance literature:: With hydrogenchloride; potassium hydroxide; In dimethyl sulfoxide; at 20 - 25 ℃; for 0.5h;
DOI:10.1016/S0040-4020(01)91141-X

Reference yield:

: 99-65-0
meta-dinitrobenzene

: 7205-98-3
chloromethyl phenyl sulfone

: 93244-96-3
2,6-Dinitrobenzyl phenyl sulfone

: 89303-44-6
1-Benzenesulfonylmethyl-2,4-dinitro-benzene

Guidance literature:: With potassium tert-butylate; acetic acid; In tetrahydrofuran; at -50 - 20 ℃; for 0.5h; Yield given. Yields of byproduct given;
DOI:10.1016/S0040-4020(01)91141-X

Reference yield:

: 873-55-2
sodium benzenesulfonate

: 89303-44-6
1-Benzenesulfonylmethyl-2,4-dinitro-benzene

Guidance literature:: Multi-step reaction with 2 steps

1: 59 percent / dimethylsulfoxide / 4 h / Heating

2: 80 percent / KOH / dimethylsulfoxide / 1 h / Ambient temperature

With potassium hydroxide; In dimethyl sulfoxide;
DOI:10.1021/jo00183a003