1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene

Base Information

• Chemical Name: 1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene
• CAS No.: 67745-30-6
• Molecular Formula: C₁₈H₁₃NO₂S₂
• Molecular Weight: 339.439
• DSSTox Substance ID: DTXSID30500689
• Wikidata: Q82352513

Synonyms:67745-30-6;1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene;DTXSID30500689

Chemical Property of 1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene

Chemical Property:

• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 339.03877100
• Heavy Atom Count: 23
• Complexity: 376

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])SC3=CC=CC=C3

Technology Process of 1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene

There total 3 articles about 1,1'-[(4-Nitro-1,2-phenylene)disulfanediyl]dibenzene 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: 30.0%

diphenyldisulfane (882-33-7) + 4-Nitroanthranilic acid (619-17-0) → 1,2-bis(phenylthio)-4-nitrobenzene (67745-30-6)

Guidance literature:

With isopentyl nitrite; In 1,4-dioxane; 1,2-dichloro-ethane; for 0.5h; Heating;

DOI:10.1246/bcsj.59.2907

Reference yield:

sodium thiophenolate (930-69-8) + 1-chloro-2,4-dinitro-benzene (97-00-7) → 1,2-bis(phenylthio)-4-nitrobenzene (67745-30-6)

Guidance literature:

DOI:10.1021/jo01329a010

Reference yield:

→ 1,2-bis(phenylthio)-4-nitrobenzene (67745-30-6)

Guidance literature:

/BRN= 818163/, DMF, Natriumthiophenolat;

upstream raw materials:

diphenyldisulfane

4-Nitroanthranilic acid

sodium thiophenolate

1-chloro-2,4-dinitro-benzene

Downstream raw materials:

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

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