68494-08-6

Basic information

• Product Name: 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE
• Synonyms: 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE;RARECHEM AR PA 0054;S-[5-(BENZOYLTHIO)-2-THIOXO-1,3-DITHIOL-4-YL] BENZENECARBOTHIOATE;4,5-Bis(benzoylthio)-1,3-dithiol-2-thione;4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE 97%;4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE 98+%
• CAS NO: 68494-08-6
• Molecular Formula: C₁₇H₁₀O₂S₅
• Molecular Weight: 406.59
• Product Categories: Sulphur Derivatives;Charge Transfer Complexes (Synthetic Intermediates);Charge Transfer Complexes for Organic Metals;Functional Materials
• Mol File: 68494-08-6.mol
• Article Data: 9

Chemical Properties

• Melting Point: 139-143 °C
• Boiling Point: 512.1°Cat760mmHg
• Flash Point: 263.5°C
• Appearance: /
• Density: 1.55g/cm³
• Solubility: almost transparency in Chloroform
• CAS DataBase Reference: 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE(CAS DataBase Reference)
• NIST Chemistry Reference: 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE(68494-08-6)
• EPA Substance Registry System: 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE(68494-08-6)

Safety Data

• Safety Statements: 22-24/25
• WGK Germany: 3
• F: 10-13-23
• Hazardous Substances Data: 68494-08-6(Hazardous Substances Data)

Usage

General Description

4,5-Bis(benzoylthio)-1,3-dithiole-2-thione is a chemical compound with the molecular formula C18H10S4O2. It is a dithiolethione derivative containing benzoylthio groups. 4,5-BIS(BENZOYLTHIO)-1,3-DITHIOLE-2-THIONE exhibits antioxidative and anti-inflammatory properties, making it a potential candidate for pharmaceutical and medicinal applications. It has shown promising results in various studies for its potential use in treating conditions such as cancer, diabetes, and cardiovascular diseases. Additionally, 4,5-Bis(benzoylthio)-1,3-dithiole-2-thione has been researched for its ability to modulate gene expression and cellular responses, suggesting potential therapeutic benefits in various diseases and conditions.

Upstream product

• 75-15-0 carbon disulfide 
• 2819-08-1 benzoyl acetate 
• 98-88-4 benzoyl chloride 
• 72022-68-5 bis(tetraethylammonium)bis(2-thioxo-1,3-dithiole-4,5-dithiolate)zincate 
• 74-88-4 methyl iodide 

Downstream Products

• 204252-47-1 μ-(2-thioxo-1,3-dithiole-4,5-dithiolato)bis[(tris(p-methoxyphenyl)phosphine)gold(I)] 
• 96133-64-1 4,5-bis(p-methoxybenzylthio)-1,3-dithiole-2-thione 
• 117408-73-8 Benzo<1,2-g;4,5-g'>bis<1,3>dithiolo<4,5-b><1,4>dithiocine-2,10-dithione 
• 111082-47-4 4,5-(phenyl-ethylenedithio)-1,3-dithiole-2-thione 
• 138206-22-1 4,5-Bis-(2,4-dinitro-phenylsulfanyl)-[1,3]dithiole-2-thione 
• 59065-21-3 4,5-bis(2-ethylsulfanyl)-1,3-dithiole-2-thione 
• 88203-73-0 Tetrakis(benzoylthio)-tetrathiofulvalen 
• 68494-09-7 4,5-bis(benzoylthio)-1,3-dithiole-2-one 
• 136414-46-5 6-(4-Methoxy-phenyl)-10aH-1,3,4,5-tetrathia-cyclohepta[e]indene-2-thione 
• 136414-45-4 6-Phenyl-10aH-1,3,4,5-tetrathia-cyclohepta[e]indene-2-thione 
• 65-85-0 benzoic acid 
• 136414-44-3 10aH-1,3,4,5-Tetrathia-cyclohepta[e]indene-2-thione 
• 70800-59-8 1,3,4,6-tetrathiapentalene-2-thione 

Relevant articles and documents

Vibration assignment of carbon-sulfur bond in 2-thione-1,3-dithiole-4,5-dithiolate derivatives

The higher frequency peak near 1050 cm-1 of the doublet in the infrared and Raman spectra of 2-thione-1,3-dithiole-4,5-dithiolate (DMIT) derivatives corresponds mainly to the stretching vibration of carbon-sulfur double bond in the terminal S=C

The synthesis of anthracene, and dipyridine salts as cations for DMIT complexes

The synthesis of a series of cations for the preparation of [Ni(dmit) 2]2 complexes is described. These cations are a series of 9,10-disubstituted anthracene derivatives with phosphane or alkylamine sustituents. Metal catalysed coupling reactions were used to prepare the 9,10-ethynylanthracene derivatives, one of which was subsequently methylated, using iodomethane as methylating reagent, to form cations for [Ni(dmit) 2]2-salts. A range of salts were prepared using ferrocene and anthracene-based cations with [Ni(dmit)2]2- as the dianion.

Biscrown-annulated TTFAQ-dianthracene hybrid: Synthesis, structure, and metal ion sensing

A new fluorescence chemosensor (3) made up of a biscrown-annulated TTFAQ receptor and two anthracene fluorophores was designed and synthesized. Its solid-state structure was disclosed by X-ray crystallographic analysis, while fluorescence titrations indic