78068-85-6

Basic information

• Product Name: 3-Chloro-4-fluorobenzotrifluoride
• Synonyms: 2-Chloro-1-fluoro-4-(trifluoromethyl)benzene, 3-Chloro-alpha,alpha,alpha,4-tetrafluorotoluene;3-chloro -4-fluorine three fluorine toluene;3-4 - three fluorine fluorine chlorine - toluene;3-chloro-4-fluorotrifluorotoluene;3-Chloro-Α,Α,Α,4-Tetrafluorotoluene;2-CHLORO-1-FLUORO-4-(TRIFLUOROMETHYL)BENZENE;1-chloro-2-fluoro-5-(trifluoromethyl)-benzene;3-CHLORO-4-FLUORO-1-(TRIFLUOROMETHYL)BENZENE
• CAS NO: 78068-85-6
• Molecular Formula: C₇H₃ClF₄
• Molecular Weight: 198.55
• EINECS: -0
• Product Categories: Fluorine series;Trifluoromethylbenzene serise;Aromatic Hydrocarbons (substituted) & Derivatives;API intermediates;organofluorine compounds
• Mol File: 78068-85-6.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 137℃
• Flash Point: 42°(108°F)
• Appearance: /
• Density: 1,49 g/cm3
• Vapor Pressure: 1040mmHg at 25°C
• Refractive Index: 1.4355
• Storage Temp.: 0-10°C
• Solubility: Chloroform, Methanol
• BRN: 4309386
• CAS DataBase Reference: 3-Chloro-4-fluorobenzotrifluoride(CAS DataBase Reference)
• NIST Chemistry Reference: 3-Chloro-4-fluorobenzotrifluoride(78068-85-6)
• EPA Substance Registry System: 3-Chloro-4-fluorobenzotrifluoride(78068-85-6)

Safety Data

• Hazard Codes: Xi,Xn
• Statements: 36/37/38-20/21/22
• Safety Statements: 26-36
• RIDADR: 1993
• TSCA: Yes
• HazardClass: 3
• PackingGroup: Ⅲ
• Hazardous Substances Data: 78068-85-6(Hazardous Substances Data)

Usage

Description

3-Chloro-4-fluorobenzotrifluoride is an organic compound characterized by the presence of a chlorine atom at the 3rd position and a fluorine atom at the 4th position on a benzene ring, with three fluorine atoms attached to the same carbon atom. This unique molecular structure endows it with specific chemical properties that make it a valuable intermediate in various chemical reactions.

Uses

Used in Pharmaceutical Industry:
3-Chloro-4-fluorobenzotrifluoride is used as a reagent for the synthesis of β-substituted 3-(4-aryloxyaryl)propanoic acid, which are known as GPR40 agonists. These agonists play a crucial role in the development of drugs targeting the treatment of type 2 diabetes and metabolic disorders. 3-Chloro-4-fluorobenzotrifluoride's ability to form stable intermediates and facilitate specific chemical transformations makes it an essential component in the synthesis process.

InChI:InChI=1/C6F10/c7-2-1(5(12,13)14)3(8,9)6(15,16)4(2,10)11

Upstream product

• 367-86-2 1-fluoro-2-nitro-4-trifluoromethyl-benzene 
• 328-84-7 1,2-dichloro-4-(trifluoromethyl)benzene 
• 39885-50-2 2-chloro-4-(trifluoromethyl)aniline 

Downstream Products

• 905725-11-3 C₁₆H₁₀ClF₃O₂ 
• 138031-45-5 ethyl 2-[6-(2-chloro-4-trifluoromethylphenoxy)indazol-1-yl] propionate 
• 55407-23-3 2-Chloro-α,α,α-trifluoro-p-tolyl m-fluorophenyl ether 
• 79576-17-3 m-[(2,-Chloro-α,α,α-trifluoro-p-tolyl)oxy]aniline 
• 80175-36-6 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzaldehyde 
• 76338-73-3 2-(2-chloro-α,α,α-trifluoro-p-toluidino)-3-methylbutyric acid 
• 926297-04-3 ethyl (2E)-3-{2-[2-chloro-4-(trifluoromethyl)phenoxy]-4-(2-methoxyethoxy)phenyl}acrylate 
• 261763-02-4 3-chloro-2-fluoro-5-(trifluoromethyl)benzaldehyde 
• 1198578-80-1 sodium (3-chloro-2-fluoro-5-trifluoromethyl-phenyl)-hydroxy-methanesulfonate 
• 129931-45-9 3-chloro-2-fluoro-5-(trifluoromethyl)benzoic acid 
• 161462-33-5 1-cyano-2-methylthio-4-trifluoromethylbenzene 
• 1813-33-8 2-chloro-4-trifluoromethyl-benzonitril 
• 710982-51-7 1-benzyl-5-(2-chloro-4-trifluoromethyl-phenoxy)-1H-indole 

Relevant articles and documents

Method for preparation of fluoroamine cyanchrysanthemic acid with non-metal catalyst

The invention discloses a method for preparation of fluoroamine cyanchrysanthemic acid with non-metal catalyst. The method includes the steps of: adding a catalyst into 3, 4-dichloro-benzotrifluoride and potassium fluoride in an organic solvent at 0-200DE

Process for producing aromatic chlorine compounds

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A Facile Preparation of Fluoropyridines from Aminopyridines via Diazotation and Fluorodediazoniation in HF or HF-Pyridine Solutions

Fluoropyridines were prepared in high yields by dizotation of aminopyridines in HF or HF-pyridine solutions, followed by dediazoniation in situ at 20-60 deg C.