13420-58-1

Basic information

• Product Name: 2-(3-chlorophenylthio)benzoic acid
• Synonyms: 2-(3-chlorophenylthio)benzoic acid;Einecs 236-529-0
• CAS NO: 13420-58-1
• Molecular Formula: C₁₃H₉ClO₂S
• Molecular Weight: 264.72736
• EINECS: 236-529-0
• Mol File: 13420-58-1.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 417.7°Cat760mmHg
• Flash Point: 206.4°C
• Appearance: /
• Density: 1.42g/cm³
• Vapor Pressure: 1E-07mmHg at 25°C
• Refractive Index: 1.683
• CAS DataBase Reference: 2-(3-chlorophenylthio)benzoic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(3-chlorophenylthio)benzoic acid(13420-58-1)
• EPA Substance Registry System: 2-(3-chlorophenylthio)benzoic acid(13420-58-1)

Safety Data

• Hazardous Substances Data: 13420-58-1(Hazardous Substances Data)

Usage

Compound structure

2-(3-chlorophenylthio)benzoic acid consists of a benzoic acid molecule attached to a 3-chlorophenylthio group.

Usage

Commonly used as a precursor in the synthesis of various pharmaceutical and agricultural products.

Enzyme inhibition

Known for its ability to inhibit the production of certain enzymes, such as cyclooxygenase-2, which play a role in inflammation and pain.

Anti-cancer properties

Has been studied for its potential anti-cancer properties, as it has been found to inhibit the growth of certain types of cancer cells.

Chemical structure importance

Its chemical structure and properties make it a valuable compound in various fields of research and industry.

InChI:InChI=1/C13H9ClO2S/c14-9-4-3-5-10(8-9)17-12-7-2-1-6-11(12)13(15)16/h1-8H,(H,15,16)

Upstream product

• 108-37-2 1-bromo-3-chlorobenzene 
• 147-93-3 Thiosalicylic acid 
• 2037-31-2 3-chlorophenylthiol 
• 88-67-5 2-Iodobenzoic acid 

Downstream Products

• 38605-72-0 1-chlorothioxanthen-9-one 
• 107623-98-3 methyl 2-(3-chlorophenylsulfanyl)benzoate 
• 108476-40-0 2-(3-chloro-phenylsulfanyl)-benzoic acid ethyl ester 
• 6469-87-0 3-chloro-9H-thioxanthen-9-one 
• 13420-61-6 [2-(3-Chloro-phenylsulfanyl)-phenyl]-acetonitrile 
• 13420-62-7 [2-(3-Chloro-phenylsulfanyl)-phenyl]-acetic acid 
• 13420-60-5 C₁₃H₁₀Cl₂S 
• 13420-59-2 [2-(3-Chloro-phenylsulfanyl)-phenyl]-methanol 

Relevant articles and documents

Triplet decay-induced negative temperature dependence of the transient photoluminescence decay of thermally activated delayed fluorescence emitter

The photophysical properties of three TX-based D-A isomers (TXO-PhCz1, TXO-PhCz3, and TXO-PhCz4) with a PhCz donor at different substitution positions of phenyl group on a TXO unit were investigated. The substitution position of the PhCz unit significantly impacts the photophysical properties of these isomers. TXO-PhCz1 exhibits a very weak emission in both undoped and doped films, while TXO-PhCz3 and TXO-PhCz4 exhibit a strong emission with the requisite properties for TADF emitters, including a small ΔEST and transient PL decay curves with a prompt and delayed fluorescent component. TXO-PhCz4 exhibits a much stronger orbital coupling than TXO-PhCz3 and then the phosphorescent emission causes the inverse temperature dependence of the transient PL decay, which is contrary to that of TXO-PhCz3 and other TADF emitters. TXO-PhCz4 exhibits a small ΔEST of 23 meV and a short decay time of 14 μs at room temperature, which are much smaller and shorter than those of TXO-PhCz3. Multilayer OLEDs based on TXO-PhCz4 exhibit a very low-efficiency roll-off with a maximum current efficiency of 49.2 cd A-1, a maximum power efficiency of 47.7 lm W-1, and a maximum EQE of 16.3%.

Lyophilized thioxanthenone antitumor agents

Disclosed are reconstituted lyophilized formulations for the treatment of mammalian tumors comprising a thioxanthenone antitumor agent in combination with mannitol or sucrose as a stabilizer in a lactate buffer.

The synthesis of hycanthone

-