1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene

Base Information

• Chemical Name: 1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene
• CAS No.: 70415-98-4
• Molecular Formula: C₂₄H₁₈O₆S₃
• Molecular Weight: 498.601
• DSSTox Substance ID: DTXSID60500692
• Wikidata: Q82352519
• Mol file: 70415-98-4.mol

Synonyms:70415-98-4;1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene;DTXSID60500692

Chemical Property of 1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene

Chemical Property:

• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 498.02655181
• Heavy Atom Count: 33
• Complexity: 951

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Technology Process of 1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene

There total 15 articles about 1,1',1''-(Benzene-1,2,4-triyltrisulfonyl)tribenzene 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:

benzene-1,2,4-triyltris(phenylsulfane) (3379-34-8) → 1,2,4-tris-benzenesulfonyl-benzene (70415-98-4)

Guidance literature:

With dihydrogen peroxide; acetic acid;

DOI:10.1021/jo01329a010

Reference yield:

sodium thiophenolate (930-69-8) → 1,2,4-tris-benzenesulfonyl-benzene (70415-98-4)

Guidance literature:

Multi-step reaction with 2 steps

2: aq. H₂O₂, AcOH

With dihydrogen peroxide; acetic acid;

DOI:10.1021/jo01329a010

Reference yield:

5-benzenesulfonyl-2-nitro-aniline (24509-46-4) → 1,2,4-tris-benzenesulfonyl-benzene (70415-98-4)

Guidance literature:

Multi-step reaction with 6 steps

2: aqueous ethanol

3: aqueous ethanol; dioxane

4: glacial acetic acid; aqueous H₂O₂

5: ethanol; dioxane

6: glacial acetic acid; aqueous H₂O₂

With 1,4-dioxane; ethanol; dihydrogen peroxide; acetic acid;

DOI:10.1039/jr9390000902

upstream raw materials:

2,4-bis-benzenesulfonyl-1-phenylsulfanyl-benzene

benzene-1,2,4-triyltris(phenylsulfane)

2,4-bis(phenylthio)nitrobenzene

1-amino-3-phenylsulfonylbenzene