139057-86-6

Basic information

• Product Name: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
• Synonyms: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE;TIMTEC-BB SBB006632;4-FLUOR-3-(TRIFLUORMETHYL)-PHENYLISOCYAN;Benzene, 1-fluoro-4-isocyanato-2-(trifluoromethyl)- (9CI);4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE 97%;4-Fluoro-3-(trifluoromethyl)phenyl isocyanate,97%;2-Fluoro-5-isocyanatobenzotrifluoride;4-Fluoro-3-(trifluoroMethyl)phenyl isocyanate, 97% 500MG
• CAS NO: 139057-86-6
• Molecular Formula: C8H3F4NO
• Molecular Weight: 205.11
• Product Categories: ISOCYANATE;Isocyanates;Nitrogen Compounds;Organic Building Blocks
• Mol File: 139057-86-6.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 48 °C1 mm Hg(lit.)
• Flash Point: 176 °F
• Appearance: /
• Density: 1.44 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.85mmHg at 25°C
• Refractive Index: n20/D 1.461(lit.)
• CAS DataBase Reference: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(139057-86-6)
• EPA Substance Registry System: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(139057-86-6)

Safety Data

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: UN 2922 8/PG 1
• WGK Germany: 3
• Hazardous Substances Data: 139057-86-6(Hazardous Substances Data)

Usage

Chemical Properties

clear colorless liquid

Uses

4-Fluoro-3-(trifluoromethyl)phenyl isocyanate may be used in the synthesis of the following:pyrazine and pyrimidine analogs of biarylaminesN-[trans-5-(3-cyanophenyl)bicyclo[3.1.0]hex-2-yl]-N′-[4- fluoro-3-(trifluoromethyl)phenyl]-N-[2-(3(R)-hydroxy-1-pyrrolidinyl]ethyl]ureaN-[trans-5-(3-cyanophenyl)bicyclo[3.1.0]hex-2-yl]-N′-[4- fluoro-3-(trifluoromethyl)phenyl]-N-[2-(4-methyl-1-piperazinyl)- ethyl]urea

InChI:InChI=1/C8H3F4NO/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h1-3H