58593-78-5

Usage

Uses

Used in Chemical Synthesis:
4-Chloro-1,3-benzenedithiol is used as a chemical intermediate for the synthesis of various organic compounds. Its unique structure and reactivity make it a valuable building block in the preparation of pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Research:
4-CHLORO-1,3-BENZENEDITHIOL is also utilized in scientific research to study the properties and reactions of benzenoid compounds. Its ability to form strong metallic bonds makes it an interesting subject for investigating the formation of metal organic frameworks and ligands.
Used in Metal Organic Frameworks (MOFs):
4-Chloro-1,3-benzenedithiol is used as a ligand in the construction of metal organic frameworks. Its sulfur atoms can coordinate with metal ions, contributing to the formation of stable and porous structures with potential applications in gas storage, catalysis, and drug delivery.
Used in Ligand Design:
In the field of coordination chemistry, 4-chloro-1,3-benzenedithiol is employed as a ligand to design and synthesize metal complexes with specific properties. These complexes can be used in various applications, such as catalysts, sensors, and materials with unique electronic or magnetic properties.
Note: While there is minimal data available on the toxicity or harmful effects of 4-chloro-1,3-benzenedithiol on human and environmental health, it is essential to handle this chemical with caution. Overexposure or incorrect handling could lead to health risks.

InChI:InChI=1/C6H5ClS2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H/p-2

Upstream product

• 2891-17-0 4-chloro-1,3-benzenedisulfonyl dichloride 
• 5131-60-2 4-chloro-1,3-phenylenediamine 

Downstream Products

• 860687-79-2 1-chloro-2,4-bis-(2,2-dimethoxy-ethylsulfanyl)-benzene 
• 78987-58-3 1-chloro-2,4-bis-methylsulfanyl-benzene 
• 5172-57-6 1-Chloro-2,4-bis-trifluoromethylsulfanyl-benzene 
• 79520-58-4 5-[2-Chloro-5-(4-methoxycarbonyl-4-methyl-pentylsulfanyl)-phenylsulfanyl]-2,2-dimethyl-pentanoic acid methyl ester 
• 211-02-9 Benzo<1,2-b:3,4-b'>dithiophen 
• 95151-66-9 ((CH₃)3Sn)2C₆H₃ClS₂ 
• 95151-77-2 {((C₆H₅)3Pb)2C₆H₃ClS₂} 
• 95151-75-0 {(C₆H₅)2Pb(C₆H₃ClS₂)}2 
• 95151-68-1 ((C₆H₅)3Sn)2C₆H₃ClS₂ 
• 95151-73-8 {((C₂H₅)3Pb)2C₆H₃ClS₂} 
• 95183-09-8 ((CH₃)3Pb)2C₆H₃ClS₂ 

Relevant academic research and scientific papers

An increased internal rotational barrier in thiophenol caused by meta substituents

The twofold internal barriers to rotation about the C-S bond in 3,5-diX-thiophenols were determined in solution from long-range spin-spin coupling constants.They are 3.4, 4.85, 5.3, 6.45, and 7.25 +/- 10percent kJ/mol for X = H, CH3, OCH3, F, and Cl, respectively.In 3,5-dichloro-4-hydroxythiophenol, V2 is -0.8 kJ/mol as compared to -1.9 kJ/mol in 4-methoxythiophenol.The para substituent here dominates.The observed barriers are in rough agreement with arguments based on perturbation molecular orbital theory and with MO calculations of changes in the barrier caused by substituents.The computed values appear as nearly pure twofold barriers with very small fourfold components.