13735-04-1

Basic information

• Product Name: 3-(4-BroMophenylthio)propionic acid, 98%
• Synonyms: 3-(4-BroMophenylthio)propionic acid, 98%;3-(4-Bromothiophenoxy)propionic acid;3-[(4-bromophenyl)sulfanyl]propanoic acid
• CAS NO: 13735-04-1
• Molecular Formula: C₉H₉BrO₂S
• Molecular Weight: 261
• Mol File: 13735-04-1.mol
• Article Data: 15

Chemical Properties

• Melting Point: 109-112℃
• Boiling Point: 388.542°C at 760 mmHg
• Flash Point: 188.784°C
• Appearance: /
• Density: 1.62g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.639
• PKA: 4.25±0.10(Predicted)
• CAS DataBase Reference: 3-(4-BroMophenylthio)propionic acid, 98%(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-BroMophenylthio)propionic acid, 98%(13735-04-1)
• EPA Substance Registry System: 3-(4-BroMophenylthio)propionic acid, 98%(13735-04-1)

Safety Data

• Hazardous Substances Data: 13735-04-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C9H9BrO2S/c10-7-1-3-8(4-2-7)13-6-5-9(11)12/h1-4H,5-6H2,(H,11,12)

Upstream product

• 107-94-8 chloropropionic acid 
• 106-53-6 para-bromobenzenethiol 
• 141-76-4 3-iodopropanoic acid 
• 16987-03-4 sodium 3-chloroproanoate 
• 590-92-1 3-Bromopropionic acid 
• 79-10-7 acrylic acid 
• 13457-82-4 4-bromothiophenol sodium salt 
• 57-57-8 β-Propiolactone 
• 107-96-0 3-mercaptopropionic acid 

Downstream Products

• 244241-10-9 ethyl 4-<(4-(4-(1,1-dimethylethyl)phenyl)-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 188889-29-4 ethyl 4-<(4-trifluorosulfonyloxy-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 244241-08-5 ethyl 4-<(4-(4-ethylphenyl)-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 244241-09-6 ethyl 4-<(4-(4-(1-methylethyl)phenyl)-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 188888-61-1 ethyl 4-<(4-(4-methylphenyl)-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 244241-07-4 ethyl 4-<(4-phenyl-(2H)-thiochromen-6-yl)ethynyl>benzoate 
• 188889-27-2 ethyl 4-<2-(4-oxo-thiochroman-6-yl)ethynyl>benzoate 
• 13735-13-2 6-bromo-2,3-dihydro-4H-1-benzothiopyran4-one 

Relevant articles and documents

Design, synthesis, and biological evaluation of 4-chloro-2H-thiochromenes featuring nitrogen-containing side chains as potent antifungal agents

A series of 4-chloro-2H-thiochromenes featuring nitrogen-containing side chains were designed, synthesized and tested in vitro for their antifungal activities. The results of preliminary antifungal tests showed that most target compounds exhibited good inhibitory activities against Candida albicans, Cryptococcus neoformans, Candida tropicalis. Notably, compounds 10e and 10y showed most potent activity in vitro against a variety of fungal pathogens with low MICs. Meanwhile, low cytotoxicity on mammalian cells has been observed for compounds 10e and 10y in the tested concentrations by the MTT assay. Therefore, the 4-chloro-2H-thiochromenes with nitrogen-containing groups provide new lead structures in the search for novel antifungal agents.

Synthesis of benzothiazonine by rhodium-catalyzed denitrogenative transannulation of 1-sulfonyl-1,2,3-triazole and thiochromone

A facile synthesis of multi-functionalized benzothiazonine was achieved by the rhodium-catalyzed denitrogenative annulation of 1-sulfonyl-1,2,3-triazole and thiochromone. In view of the excellent atom economy, broad substrate scope and easy availability of starting materials, the protocol provided an efficient strategy for the construction of mediumN,S-heterocycles.

Synthesis and anti cervical cancer activity of novel 5H-thiochromeno [4,3-d]pyrimidines

A series of novel 5H-Thiochromeno[4,3-d]pyrimidine derivatives were synthesized, purified and characterized by different spectroscopy techniques such as1H NMR,13C NMR, Mass and Elemental Analysis. The new compounds were evaluated for their anti-cervical cancer activity on Human Cervical Cell Line HeLa. They were found to be potent anti-cervical cancer agents with GI50 values less than 10 μg/mL with respect to positive control drug Adriamycin.