6320-02-1

Basic information

• Product Name: 2-BROMOTHIOPHENOL
• Synonyms: 2-BROMOBENZENETHIOL;2-BROMOTHIOPHENOL;O-BROMOBENZENETHIOL;2-bromo-benzenethio;Benzenethiol, 2-bromo-;Benzenethiol, o-bromo-;o-Bromothiophenol;2-Bromophenyl mercaptan
• CAS NO: 6320-02-1
• Molecular Formula: C₆H₅BrS
• Molecular Weight: 189.07
• EINECS: 228-665-4
• Product Categories: Phenol&Thiophenol&Mercaptan
• Mol File: 6320-02-1.mol
• Article Data: 8

Chemical Properties

• Melting Point: 220-222 °C(Solv: isopropanol (67-63-0))
• Boiling Point: 128-130 °C25 mm Hg(lit.)
• Flash Point: >230 °F
• Appearance: colorless to very deep yellow/Liquid
• Density: 1.573 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0568mmHg at 25°C
• Refractive Index: n20/D 1.635(lit.)
• Storage Temp.: −20°C
• PKA: 5.90±0.43(Predicted)
• Sensitive: Stench
• BRN: 2039769
• CAS DataBase Reference: 2-BROMOTHIOPHENOL(CAS DataBase Reference)
• NIST Chemistry Reference: 2-BROMOTHIOPHENOL(6320-02-1)
• EPA Substance Registry System: 2-BROMOTHIOPHENOL(6320-02-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-7/9
• RIDADR: UN2922
• WGK Germany: 3
• F: 10-13-23
• TSCA: T
• HazardClass: 8
• PackingGroup: III
• Hazardous Substances Data: 6320-02-1(Hazardous Substances Data)

Usage

Description

2-Bromothiophenol, also known as 2-Bromobenzenethiol, is a clear yellow liquid that is capable of undergoing chemical reactions, such as forming nitro-sulphide when it reacts with 4-(4-bromo-3-nitro-phenyl)morpholine. 2-BROMOTHIOPHENOL has potential applications in various industries due to its unique chemical properties.

Uses

Used in Chemical Synthesis:
2-Bromothiophenol is used as a chemical intermediate for the synthesis of various organic compounds. Its reactivity with other molecules makes it a valuable building block in the creation of new chemical entities.
Used in Pharmaceutical Industry:
2-Bromothiophenol is used as a starting material for the development of pharmaceutical compounds. Its unique structure and reactivity can be exploited to design and synthesize new drugs with potential therapeutic applications.
Used in Material Science:
2-Bromothiophenol can be utilized in the development of novel materials, such as polymers and coatings, due to its chemical properties. Its ability to form nitro-sulphide compounds can be particularly useful in creating materials with specific properties for various applications.
Used in Research and Development:
2-Bromothiophenol serves as a valuable compound for research purposes, particularly in the fields of organic chemistry and materials science. It can be used to study reaction mechanisms, explore new synthetic routes, and develop innovative applications in various industries.

InChI:InChI=1/C6H5BrS/c7-5-3-1-2-4-6(5)8/h1-4,8H/p-1

Upstream product

• 108-98-5 thiophenol 
• 15939-85-2 2-((2-bromophenyl)thio)acetic acid 
• 583-55-1 1-Bromo-2-iodobenzene 
• 34835-57-9 2-bromo benzene diazonium chloride 
• 615-36-1 2-bromoaniline 
• 39128-19-3 (2-bromophenyl)ethylxanthate 
• 17333-81-2 o-bromobenzenediazonium 
• 140-89-6 potassium ethyl xanthogenate 

Downstream Products

• 71112-91-9 bis(2-bromophenyl) disulfide 
• 103052-99-9 S-(2-bromophenyl) ethanethioate 
• 100125-58-4 2-bromophenyl 4-chloro-2-nitrophenyl sulfide 
• 18587-37-6 5-(2-bromo-phenylsulfanyl)-3-methyl-4-nitro-isothiazole 
• 15812-83-6 (2-bromophenyl)(4-methoxy-2-nitrophenyl)sulfane 
• 83782-30-3 2-(((2-bromophenyl)thio)methyl)pyridine 
• 2688-96-2 2-phenylbenzenethiol 
• 75288-48-1 2-chloroprop-2-enyl 2-bromophenyl sulphide 
• 75723-83-0 4-(o-bromothiophenoxy)tetrachloropyridine 
• 117341-27-2 2-<(2-Methoxyethyl)thio>bromobenzene 
• 84998-61-8 C₁₀H₁₄BrPS 
• 88127-63-3 C₁₀H₁₆BrN₂PS 
• 345946-41-0 C₂₆H₂₀Br₂S₄ 
• 154180-30-0 allyl (2-bromophenyl) thioether 

Relevant articles and documents

SINGLE-STEP SYNTHESIS METHOD OF ARYL THIOL AND APPLICATION THEREOF

The present invention relates to a single-step synthesis method of aryl thiol, and more specifically, to a method of synthesizing aryl thiol in a single-step by making aryl halide react with alkane dithiol in the presence of a transition metal catalyst. According to the present invention, a single-step synthesis method using the transition metal catalyst, the synthesis method which is capable of synthesizing aryl thiol from aryl halide at a high yield, can be provided. Various aryl halides may be applied to the synthesis method. Further, the synthesis method has advantages that an easily usable reagent may be used, operations are simple, and reactions can be performed under mild conditions. In addition, the synthesized aryl thiol may be used in the synthesis of advanced molecules such as diaryl sulfides and benzothiophenes.COPYRIGHT KIPO 2017

Oxidative cleavage of S-Arylmercaptoacetic acids by pyridinium chlorochromate: Kinetic and correlation analysis

Kinetics of oxidation of 24 S-Arylmercaptoacetic acids (SAMA) by pyridinium chlorochromate (PCC) have been studied in acid medium. The product of oxidation is the corresponding thiophenol. The rate data of meta- and para-substituted acids have been correlated well with σI, σ°R values and the meta-compounds correlate well with F,R values. The reaction constants are negative and of smaller magnitudes. Further, the ortho-substituted acids show a good correlation with triparametric equation involving Taft's σI and σ°R and charton's steric parameter v. There is no considerable steric contribution to the total orthosubstituent effect. Based on these observations, the mechanism involving the formation of protonated arylsulfinylacetic acid intermediate, followed by an intramolecular rearrangement leading to the product thiophenol has been proposed.

Oxidative Cleavage of S-Arylmercaptoacetic Acids by Sodium Perborate: Kinetic and Correlation Study

Kinetics of oxidation of twenty six S-arylmercaptoacetic acids (SAMA) (I) by sodium perborate (PB) have been studied in acid medium.The product of oxidation is the corresponding thiophenol.The rate data of meta- and para-substituted acids have been correlated with DSP equations.While the para-compounds correlate well with ?I and ?0R values, the meta-compounds correlate well with ?I and ?-R values.The reaction constants are negative and of smaller magnitudes.Further, the ortho-substituted acids show a good correlation with a triparametric equation involving Taft's ?I and ?0R and Charton's steric parameter ν.There is a considerable steric contribution to the total ortho-substituent effect.Based on these observations, mechanism involving the formation of protonated arylsulfinylacetic acid intermediate, followed by an intramolecular rearrangement leading to the product thiophenol has been proposed.