Thianthrene 5,5,10-trioxide

Base Information

• Chemical Name: Thianthrene 5,5,10-trioxide
• CAS No.: 2362-54-1
• Molecular Formula: C12H8O3S2
• Molecular Weight: 264.326
• DSSTox Substance ID: DTXSID70450179
• Nikkaji Number: J673.111B
• Wikidata: Q82269776
• Mol file: 2362-54-1.mol

Synonyms:Thianthrene 5,5,10-trioxide;2362-54-1;Thianthrene, 5,5,10-trioxide;SCHEMBL11576261;DTXSID70450179

Chemical Property of Thianthrene 5,5,10-trioxide

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 263.99148646
• Heavy Atom Count: 17
• Complexity: 392

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)S(=O)C3=CC=CC=C3S2(=O)=O

Technology Process of Thianthrene 5,5,10-trioxide

There total 3 articles about Thianthrene 5,5,10-trioxide 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%

Thianthrene (92-85-3) → thianthrene 5,5-dioxide (2362-53-0) + thianthrene-5,5,10-trioxide (2362-54-1) + thianthrene-5,5,10,10-tetraoxide (2362-55-2) + trans-thianthrene 5,10-dioxide (2748-50-7)

Guidance literature:

With bis-[(trifluoroacetoxy)iodo]benzene; In chloroform; at 63 ℃; for 5h;

Reference yield: 35.0%

Thianthrene (92-85-3) → thianthrene 5,5-dioxide (2362-53-0) + thianthrene-5,5,10-trioxide (2362-54-1) + thianthrene-5,5,10,10-tetraoxide (2362-55-2) + trans-thianthrene 5,10-dioxide (2748-50-7) + cis-thianthrene 5,10-dioxide (2748-51-8)

Guidance literature:

With [bis(acetoxy)iodo]benzene; In chloroform; at 20 ℃; for 24h; Product distribution; Mechanism; other temperatures, other times, different sulphide/oxidizer ratio;

Reference yield:

thianthrene-5-oxide (2362-50-7) → thianthrene 5,5-dioxide (2362-53-0) + thianthrene-5,5,10-trioxide (2362-54-1) + thianthrene-5,5,10,10-tetraoxide (2362-55-2) + thianthrene 5,10-dioxide (951-02-0)

Guidance literature:

With benzyl(triethyl)ammoniumpermanganate; In dichloromethane; Mechanism; other oxidizing agents;

DOI:10.1139/v94-286

upstream raw materials:

Thianthrene

thianthrene-5-oxide

Downstream raw materials:

thianthrene-5,5,10,10-tetraoxide

dibenzothiophene sulfone

2,2'-sulfinatodibenzoate

Refernces

• 1、 Barbas, Dimitris,Spyroudis, Spyros,Varvoglis, Anastasios. "Oxidation of Organic Sulfides with benzene". . p. 2201 - 2214. Retrieved 2007/10/02.