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4-Bromo-2-chlorobenzotrifluoride

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4-Bromo-2-chlorobenzotrifluoride Basic information
Product Name:4-Bromo-2-chlorobenzotrifluoride
Synonyms:4-Bromo-2-chlorobenzotrifluoride;4-Bromo-2-chloro-1-(trifluoromethyl)benzene 4-Bromo-2-chloro-alpha,alpha,alpha-trifluorotoluene;Benzene,4-broMo-2-chloro-1-(trifluoroMethyl)-;2-chloro-4-bromotrifluorotoluene;2-chloro-4-bromo-trifluoromethylbenzene;2-Chloride-4-Bromine Benzotrifluoride;4-Bromo-2-chlorobenzotrifluoride >;4-bromo-2-chloro-1-(trifluoromethyl)benzene
CAS:467435-07-0
MF:C7H3BrClF3
MW:259.45
EINECS:
Product Categories:Trifluoromethyl-benzene series
Mol File:467435-07-0.mol
4-Bromo-2-chlorobenzotrifluoride Structure
4-Bromo-2-chlorobenzotrifluoride Chemical Properties
Boiling point 224.1±35.0 °C(Predicted)
density 1.76
refractive index 1.5040-1.5080
storage temp. Sealed in dry,Room Temperature
form clear liquid
color Colorless to Almost colorless
Safety Information
Hazard Codes Xi
HazardClass IRRITANT, IRRITANT-HARMFUL
HS Code 2903998090
MSDS Information
4-Bromo-2-chlorobenzotrifluoride Usage And Synthesis
Chemical PropertiesColorless liquid
Synthesis
4-AMINO-2-CHLOROBENZOTRIFLUORIDE

445-13-6

4-Bromo-2-chlorobenzotrifluoride

467435-07-0

The general procedure for the synthesis of 4-bromo-2-chlorobenzotrifluoride using 4-amino-2-chlorobenzotrifluoride as starting material was as follows: 4-amino-2-chlorobenzotrifluoride (9.780 g; 50.007 mmol) was dissolved in acetonitrile (65 mL), and copper(II) bromide (11.169 g; 50.007 mmol) was added to form a green, non-homogeneous mixture. The mixture was heated to 45°C. Subsequently, a solution of tert-butyl nitrite (6.53 mL; 55.008 mmol) in acetonitrile (10 mL) was added slowly and dropwise over 30 minutes. After the dropwise addition, the reaction mixture was continued to be stirred at 45°C for 2 hours. Upon completion of the reaction, the dark, inhomogeneous mixture was cooled to room temperature and purified directly by fast column chromatography (dichloromethane as eluent). After concentration under reduced pressure to remove the solvent, the target product, 4-bromo-2-chloro-1-trifluoromethylbenzene, was obtained as a yellow oil (12.820 g; 50% yield).LC-MS analysis: retention time t R = 1.10 min; [M + H]+: no ionization peak was observed.

References[1] Patent: WO2008/78291, 2008, A1. Location in patent: Page/Page column 42
4-Bromo-2-chlorobenzotrifluoride Preparation Products And Raw materials
Raw materials4-AMINO-2-CHLOROBENZOTRIFLUORIDE-->Cupric bromide-->Acetonitrile-->tert-Butyl nitrite
Tag:4-Bromo-2-chlorobenzotrifluoride(467435-07-0) Related Product Information
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