69409-98-9

Basic information

• Product Name: 2-Fluoro-4-(trifluoromethyl)aniline
• Synonyms: 2-FLUORO-4-(TRIFLUOROMETHYL)ANILINE;4-AMINO-3-FLUOROBENZOTRIFLUORIDE;2-fluoro-4-（trifluoromethyl）anline;Aminofluorobenzotrifluoride 43---;2-Fluoro-4-(trifluor;BenzenaMine, 2-fluoro-4-(trifluoroMethyl)-;4-aMino-3-flurorbenzotrifluoride;2-Fluoro-4-(trifluoromethyl)aniline, alpha,alpha,alpha,2-Tetrafluoro-p-toluidine
• CAS NO: 69409-98-9
• Molecular Formula: C₇H₅F₄N
• Molecular Weight: 179.11
• Product Categories: Aromatic Halides (substituted);Benzenes
• Mol File: 69409-98-9.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 172.8 °C at 760 mmHg
• Flash Point: 60.6 °C
• Appearance: /
• Density: 1.383 g/cm³
• Vapor Pressure: 1.3mmHg at 25°C
• Refractive Index: 1.4650
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 1.37±0.10(Predicted)
• CAS DataBase Reference: 2-Fluoro-4-(trifluoromethyl)aniline(CAS DataBase Reference)
• NIST Chemistry Reference: 2-Fluoro-4-(trifluoromethyl)aniline(69409-98-9)
• EPA Substance Registry System: 2-Fluoro-4-(trifluoromethyl)aniline(69409-98-9)

Safety Data

• Hazard Codes: Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: 2810
• HazardClass: IRRITANT
• PackingGroup: Ⅲ
• Hazardous Substances Data: 69409-98-9(Hazardous Substances Data)

Usage

General Description

2-Fluoro-4-(trifluoromethyl)aniline, also known as 2-amino-1-(trifluoromethyl)benzene, is an aromatic amine compound with the molecular formula C7H5F4N. It is a colorless to light yellow liquid that is commonly used in the pharmaceutical and agrochemical industries as a building block for the synthesis of various organic compounds. This chemical is known for its reactivity, and it can undergo various chemical reactions such as nitration, acylation, and Friedel-Crafts reactions. It is also known to be toxic if ingested or inhaled, and precautions should be taken when handling this compound in a laboratory or industrial setting.

InChI:InChI=1/C7H5F4N/c8-5-3-4(7(9,10)11)1-2-6(5)12/h1-3H,12H2

Upstream product

• 88288-14-6 2-fluoro-4-(trifluoromethyl)acetanilide 
• 455-14-1 4-trifluoromethylphenylamine 
• 349-97-3 4-(trifluromethyl)acetanilide 
• 67-56-1 methanol 
• 2339-84-6 2-fluoro-4-(trifluoromethyl)-acetanilide 
• 32137-19-2 1,2-difluoro-4-(trifluoromethyl)benzene 
• 348-54-9 2-Fluoroaniline 
• 51632-16-7 3-phenoxybenzyl bromide 
• 446-34-4 2-fluoro-4-methyl-1-nitrobenzene 
• 115029-24-8 2-fluoro-4-(trifluoromethyl)benzoic acid 
• 34913-29-6 4,4′-bis(trifluoromethyl)azobenzene 

Downstream Products

• 76338-70-0 2-(2-chloro-4-trifluoromethylphenylamino)-3-methylbutyronitrile 
• 927896-24-0 3-[2-fluoro-4-(trifluoromethyl)phenyl]-1H-pyrrole-2,5-dione 
• 1193487-71-6 6-fluoro-7-(2-fluoro-4-trifluoromethyl-phenylamino)-5-oxo-1,2,3,5-tetrahydro-indolizine-8-carboxylic acid 
• 1193487-93-2 7-(2-Fluoro-4-trifluoromethyl-phenylamino)-5-oxo-1,2,3,5-tetrahydro-indolizine-8-carboxylic acid ethyl ester 
• 401567-22-4 6-(trifluoromethyl)benzo[d]thiazole-2(3H)-thione 
• 1226805-38-4 1-chloro-3-fluoro-2-nitro-5-(trifluoromethyl)benzene 
• 1226805-39-5 1-(3-chloro-2-nitro-5-(trifluoromethyl)phenyl)-4-methyl-1H-imidazole 
• 1226805-40-8 2-chloro-6-(4-methyl-1H-imidazol-1-yl)-4-(trifluoromethyl)aniline 
• 1257138-88-7 N-(2-chloro-6-(4-methyl-1H-imidazol-1-yl)-4-(trifluoromethyl)phenyl)acetamide 
• 1260487-56-6 1-(2-fluoro-4-trifluoromethylphenyl)-3-(3-cyano-5-fluorophenyl)urea 
• 1000815-86-0 5-amino-1-(2-chloro-6-fluoro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile 
• 1472654-48-0 5-amino-1-(2-chloro-6-fluoro-4-(trifluoromethyl)phenyl)-4-(trifluoromethylsulfinyl)-1H-pyrazole-3-carbonitrile 
• 1472654-49-1 5-bromo-1-(2-chloro-6-fluoro-4-(trifluoromethyl)phenyl)-4-(trifluoromethylsulfinyl)-1H-pyrazole-3-carbonitrile 

Relevant articles and documents

Anion ligand promoted selective C-F bond reductive elimination enables C(sp2)-H fluorination

A detailed mechanism study on the anion ligand promoted selective C-H bond fluorination is reported. The role of the anion ligand has been clarified by experimental evidence and DFT calculations. Moreover, the nitrate promoted C-F bond reductive elimination enabled a selective C-H bond fluorination of various symmetric and asymmetric azobenzenes to access diverse o-fluoroanilines.

Process for producing 4-amino-3-fluorobenzotrifluoride

Disclosed is a process for producing 4-amino-3-fluorobenzotrifluoride which comprises reacting 3,4-difluorobenzotrifluoride with anhydrous ammonia (liquid ammonia or gaseous ammonia) under pressure.

Electrophilic fluorination of aromatic compounds

A process for the electrophilic ring fluorination of aromatic compounds which comprises reacting a fluorinating agent from the group consisting of CF3 OF and CF2 (OF)2 with an aromatic compound of the formula STR1 where X is selected from the group consisting of STR2 and STR3 and Y is selected from the group consisting of --H, --CF3, --CN, --NO2, --Cl, and CH3.