2252-45-1

Basic information

• Product Name: 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE
• Synonyms: 1-BROMO-3-TRIFLUOROMETHYLSULFANYL-BENZENE;3-TRIFLUOROMETHYLMERCAPTOBROMOBENZENE;3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE;3-BROMOPHENYL TRIFLUOROMETHYL SULFIDE;3-BROMOPHENYL TRIFLUOROMETHYL SULPHIDE;3-Bromophenyltrifluoromethylsulphide98%;1-Bromo-3-trifluoromethylthiobenzene;(3-BroMophenyl)(trifluoroMethyl)sulfane
• CAS NO: 2252-45-1
• Molecular Formula: C₇H₄BrF₃S
• Molecular Weight: 257.07
• Mol File: 2252-45-1.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 192-194℃
• Flash Point: 51.3±27.3℃
• Appearance: /
• Density: 1.71±0.1 g/cm3 (20 ºC 760 Torr)
• Refractive Index: 1.5117 (589.3 nm 25℃)
• Storage Temp.: Sealed in dry,Room Temperature
• Sensitive: Stench
• CAS DataBase Reference: 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE(2252-45-1)
• EPA Substance Registry System: 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE(2252-45-1)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: 1760
• HazardClass: 8
• PackingGroup: Ⅱ
• Hazardous Substances Data: 2252-45-1(Hazardous Substances Data)

Usage

General Description

3-(Trifluoromethylthio)bromobenzene is a chemical compound with the molecular formula C7H4BrF3S. It is a brominated benzene derivative with a trifluoromethylthio group attached to the benzene ring. 3-(TRIFLUOROMETHYLTHIO)BROMOBENZENE is used as a building block in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and materials. It is also utilized in the production of dyes and pigments. 3-(Trifluoromethylthio)bromobenzene is a colorless to pale yellow liquid at room temperature, and it may present hazards if not handled properly, as it is a flammable and corrosive substance.

Upstream product

• 19742-90-6 1-bromo-3-[(3-bromophenyl)disulfanyl]benzene 
• 2923-16-2 potassium trifluoroacetate 
• 81290-20-2 (trifluoromethyl)trimethylsilane 
• 2314-97-8 iodotrifluoromethane 
• 6320-01-0 3-Bromothiophenol 
• 108-86-1 bromobenzene 
• 421-17-0 Trifluoromethylsulfenyl chloride 
• 887144-97-0 Togni's reagent 
• 90942-22-6 Trichlormethyl-<3-brom-phenyl>-sulfid 

Downstream Products

• 50786-80-6 N-(m-trifluoromethylthio-phenyl)-piperazine 
• 947533-13-3 [3-(trifluoromethylthio)phenyl]boronic acid 
• 2728-70-3 1-bromo-3-[(trifluoromethyl)sulfonyl]benzene 
• 1514-25-6 phenyl-(3-trifluoromethylsulfanyl-phenyl)-amine 

Relevant articles and documents

Blue Phosphorescence with High Quantum Efficiency Engaging the Trifluoromethylsulfonyl Group to Iridium Phenylpyridine Complexes

Incorporation of an electron-withdrawing -SO2CF3 substituent to cyclometalating C^N-phenylpyridine (ppy) ligand resulted in an expected blue-shifted phosphorescence in the corresponding homoleptic Ir(ppySCF3)3 c

Metal-Free Trifluoromethylthiolation of Arylazo Sulfones

A visible-light-driven protocol for the synthesis of aryl trifluoromethyl thioethers under photocatalyst- and metal-free conditions has been pursued. The procedure exploits the peculiar properties of arylazo sulfones (having electron-rich or electron-poor substituents on the (hetero)aromatic ring) as photochemical precursors of aryl radicals and S-trifluoromethyl arylsulfonothioates as easy-to-handle trifluoromethylthiolating agents.

Fluorodecarboxylation: Synthesis of aryl trifluoromethyl ethers (ArOCF3) and thioethers (ArSCF3)

Fluorodecarboxylation of aryloxydifluoroacetic acid (ArOCF2CO2H) and arylmercaptodifluoroacetic acid (ArSCF2CO2H) towards ArXCF3 (X = O, S) using silver (I) salts in the presence of Selectfluor in a biphasic system with trifluoroacetic acid additive is discussed.