367-86-2

Basic information

• Product Name: 4-Fluoro-3-nitrobenzotrifluoride
• Synonyms: TIMTEC-BB SBB009902;Benzene, 1-fluoro-2-nitro-4-(trifluoromethyl)-;1-FLUORO-4-(TRIFLUOROMETHYL)-2-NITROBENZENE;1-FLUORO-2-NITRO-4-(TRIFLUOROMETHYL)BENZENE;2-FLUORO-5-(TRIFLUOROMETHYL)NITROBENZENE;4,ALPHA,ALPHA,ALPHA-TETRAFLUORO-3-NITROTOLUENE;4-FLUORO-3-NITROTRIFLUOROMETHYLBENZENE;4-FLUORO-3-NITROBENZOTRIFLUORIDE
• CAS NO: 367-86-2
• Molecular Formula: C₇H₃F₄NO₂
• Molecular Weight: 209.1
• EINECS: 206-702-5
• Product Categories: Aromatic Nitriles;Miscellaneous
• Mol File: 367-86-2.mol

Chemical Properties

• Boiling Point: 92 °C15 mm Hg(lit.)
• Flash Point: 92 °F
• Appearance: deep greenish-yellow/Liquid
• Density: 1.494 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.00941mmHg at 25°C
• Refractive Index: n20/D 1.462(lit.)
• Storage Temp.: Flammables area
• Water Solubility: Insoluble in water.
• BRN: 1880508
• CAS DataBase Reference: 4-Fluoro-3-nitrobenzotrifluoride(CAS DataBase Reference)
• NIST Chemistry Reference: 4-Fluoro-3-nitrobenzotrifluoride(367-86-2)
• EPA Substance Registry System: 4-Fluoro-3-nitrobenzotrifluoride(367-86-2)

Safety Data

• Hazard Codes: Xi,F
• Statements: 10-36/37/38
• Safety Statements: 26-24/25-16
• RIDADR: UN 1993 3/PG 3
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 367-86-2(Hazardous Substances Data)

Usage

Uses

Used in Chromatography:
4-Fluoro-3-nitrobenzotrifluoride is used as a derivatization reagent in the pre-column derivatization technique for High-Performance Liquid Chromatography (HPLC) with UV/VIS spectrophotometric detection of polyamines. This application aids in the detection and analysis of these biologically important compounds.
Used in Synthesis:
4-Fluoro-3-nitrobenzotrifluoride serves as a key intermediate in the synthesis of various compounds, including:
1. 2-nitro-4-trifluoromethylphenylhydrazine, which acts as a derivatization reagent for 1,2-diol compounds and oxo-steroids.
2. [3-(2-nitro-4-trifluoromethylphenyl)aminophenyl]dihydroxyborane, another derivatization reagent for 1,2-diol compounds and oxo-steroids.
3. 1-(3-chlorophenyl)-5-trifluoromethyl-3-hydrobenzimidazol-2-one, which is utilized in the development of novel chemical entities with potential applications in various fields.
These applications highlight the versatility and importance of 4-Fluoro-3-nitrobenzotrifluoride in the chemical industry, particularly in the development of new compounds and the enhancement of analytical techniques.

InChI:InChI=1/C7H5F2NO2/c8-4-5-1-2-6(9)7(3-5)10(11)12/h1-3H,4H2

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