13947-94-9

Basic information

• Product Name: 4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE
• Synonyms: 1-(ChlorodifluoroMethyl)-4-(trifluoroMethyl)benzene;4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE
• CAS NO: 13947-94-9
• Molecular Formula: C₈H₄ClF₅
• Molecular Weight: 230.56
• Mol File: 13947-94-9.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 170 °C at 760 mmHg
• Flash Point: 67.2 °C
• Appearance: /
• Density: 1.5
• Vapor Pressure: 1.99mmHg at 25°C
• Refractive Index: 1.417
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE(13947-94-9)
• EPA Substance Registry System: 4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE(13947-94-9)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 13947-94-9(Hazardous Substances Data)

Usage

General Description

4-(Chlorodifluoromethyl)benzotrifluoride is a chemical compound with the molecular formula C8H4ClF5. It is a colorless liquid that is insoluble in water and has a boiling point of 97-99 degrees Celsius. 4-(CHLORODIFLUOROMETHYL)BENZOTRIFLUORIDE is widely used as a solvent in the production of various products such as adhesives, coatings, and polyurethane foams. It is also used as a refrigerant and as a precursor in the synthesis of pharmaceuticals and agrochemicals. 4-(Chlorodifluoromethyl)benzotrifluoride is classified as a hazardous chemical and should be handled and stored with proper safety precautions in place.

InChI:InChI=1/C8H4ClF5/c9-7(10,11)5-1-3-6(4-2-5)8(12,13)14/h1-4H

Upstream product

• 160911-83-1 1-(Ethylsulfanyl-difluoro-methyl)-4-trifluoromethyl-benzene 
• 455-24-3 4-trifluoromethylbenzoic acid 
• 160911-78-4 4-Trifluoromethyl-dithiobenzoic acid ethyl ester 
• 160911-75-1 4-Trifluoromethyl-thiobenzoic acid S-ethyl ester 
• 68-36-0 1,4-bis(trichloromethyl)benzene 

Downstream Products

• 1202577-24-9 tert-Butyl[3-{4-[difluoro(4-trifluoromethylphenyl)-methoxy]phenyl}-3-ethoxypropoxy]dimethylsilane 
• 1202577-23-8 3-(tert-Butyldimethylsilyloxy)-1-{4-[difluoro-(4-trifluoromethylphenyl)methoxy]phenyl}propan-1-ol 
• 1202575-46-9 3-{4-[Difluoro(4-trifluoromethylphenyl)methoxy]phenyl}-3-ethoxypropionic acid 
• 1202577-22-7 (30A) 1-Bromo-4-[difluoro(4-trifluoromethylphenyl)methoxy]benzene 

Relevant articles and documents

Efficient synthesis of p-bis-(chlorodifluoromethyl)benzene

Selective, high yield partial fluorination of p-bis-(trichloromethyl)benzene to p-bis-(chlorodifluoromethyl)benzene has been accomplished by warming a slurry of the p-bis-(trichloromethyl)benzene in anhydrous HF which also contains a small quantity of inert solvent, such as 1,2-dichloroethane.

Method for preparing trichloromethyl-trifluoromethyl-benzenes

A process for the preparation of a trichloromethyl-trifluoromethyl-benzene of the formula STR1 wherein R1 and R2 are identical or different and represent hydrogen, fluorine or chlorine, By contacting at least one molecule of the formula STR2 wherein R1 and R2 are as previously identified, m and n are independently 0 to 3 With another molecule of the formula STR3 wherein M AND N ARE INDEPENDENTLY 0 TO 3 In the presence of a halogen transfer catalyst, optionally in the presence of a promoter.