960203-41-2

Basic information

• Product Name: 1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene
• Synonyms: 1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene;Benzene, 1-[(2-broMophenyl)thio]-2,4-diMethyl-;1-(2-broMophenylsulfanyl)-2,4-diMethylbenzene;(2-Bromophenyl)(2,4-dimethylphenyl)sulfane
• CAS NO: 960203-41-2
• Molecular Formula: C₁₄H₁₃BrS
• Molecular Weight: 293.22202
• Mol File: 960203-41-2.mol
• Article Data: 15

Chemical Properties

• Boiling Point: 329.2±30.0 °C(Predicted)
• Appearance: /
• Density: 1.40
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene(CAS DataBase Reference)
• NIST Chemistry Reference: 1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene(960203-41-2)
• EPA Substance Registry System: 1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene(960203-41-2)

Safety Data

• Hazardous Substances Data: 960203-41-2(Hazardous Substances Data)

Usage

General Description

1-[(2-Bromophenyl)thio]-2,4-dimethylbenzene, also known as 2,4-Dimethyl-1-(2-bromophenylthio)benzene, is a chemical compound with the molecular formula C14H15BrS. It is a colorless to light yellow liquid at room temperature, and is used in various industrial applications, including as a chemical intermediate in the synthesis of pharmaceuticals and agrochemicals. The compound is also known for its strong odor, and may have potential environmental and health hazards if not handled properly. It is important to follow safety guidelines and regulations when working with this chemical, due to its potential toxicity and reactivity.

Upstream product

• 583-55-1 1-Bromo-2-iodobenzene 
• 13616-82-5 2,4-dimethyl-thiophenol 
• 583-53-9 2,3-dibromobenzene 
• 94602-20-7 S-(2,4-dimethylphenyl) ethanethioate 
• 4214-28-2 1-iodo-2,4-dimethylbenzene 
• 1610527-49-5 2,4-dimethyl-1-[(2-nitro-phenyl)-sulfanyl]-benzene 
• 577-19-5 2-nitrophenyl bromide 
• 1019453-85-0 2-(2,4-dimethylphenylsulphanyl)benzeneamine 
• 6320-02-1 o-bromothiophenol 
• 1541160-62-6 1-((2-bromo)-phenylthio)pyrrolidine-2,5-dione 
• 108-38-3 m-xylene 

Downstream Products

• 960203-42-3 4-[2-(2,4-dimethylphenylsulfanyl)phenyl]piperazine-1-carboxylic acid tert-butyl ester 
• 508233-74-7 vortioxetine 
• 31317-18-7 2,4-dimethyldibenzo[b,d]thiophene 
• 960203-27-4 Vortioxetine hydrobromide 
• 960203-36-5 Vortioxetine phosphate 
• 960203-35-4 1-[2-(2,4-dimethylphenylsulfanyl)-phenyl]piperazine sulfate 
• 960203-29-6 Vortioxetine mesylate 
• 960203-37-6 Vortioxetine nitrate 
• 960203-28-5 Vortioxetine hydrochloride 
• 1293343-20-0 1-[2-(2,4-dimethylphenylsulfanyl)phenyl][1,4]diazepane hydrochloride 
• 1293343-18-6 1-[2-(2,4-dimethylphenylsulfanyl)phenyl]-4-methylpiperazine hydrochloride 

Relevant articles and documents

Regioselective C-H Thioarylation of Electron-Rich Arenes by Iron(III) Triflimide Catalysis

A mild and regioselective method for the preparation of unsymmetrical biaryl sulfides using iron(III) catalysis is described. Activation of N-(arylthio)succinimides using the powerful Lewis acid iron(III) triflimide allowed the efficient thiolation of a range of arenes, including anisoles, phenols, acetanilides, and N-heterocycles. The method was applicable for the late-stage thiolation of tyrosine and tryptophan derivatives and was used as the key step for the synthesis of pharmaceutically relevant biaryl sulfur-containing compounds such as the antibiotic dapsone and the antidepressant vortioxetine. Kinetic studies revealed that while N-(arylthio)succinimides bearing electron-deficient arenes underwent thioarylation catalyzed entirely by iron(III) triflimide, N-(arylthio)succinimides with electron-rich arenes displayed an autocatalytic mechanism promoted by the Lewis basic product.

Robust Buchwald-Hartwig amination enabled by ball-milling

An operationally simple mechanochemical method for the Pd catalysed Buchwald-Hartwig amination of arylhalides with secondary amines has been developed using a Pd PEPPSI catalyst system. The system is demonstrated on 30 substrates and applied in the context of a target synthesis. Furthermore, the performance of the reaction under aerobic conditions has been probed under traditional solution and mechanochemical conditions, the observations are discussed herein.

Preparation method of voltamethine

The invention belongs to the technical field of organic synthesis route design and raw material medicine and intermediate preparation thereof, and particularly relates to a preparation method of voltamethine. The preparation method includes: condensing 2, bromoiodobenzene and 2,4-dimethyl phenylthiophenol to generate a first intermediate; condensing the first intermediate as well as N-phenoxycarbonyl piperazin and tert-butylalcohol to generate a second intermediate; removing a Boc protective group from N-Boc-voltamethine in the second intermediate to generate a crude voltamethine via alkalineionization; purifying the crude voltamethine to obtain the voltamethine via salt purificaton and re-alkalization ionization. The preparation method is simple in obtaining of raw materials, high in product yield and purity and is suitable for industrial production.