50528-86-4

Basic information

• Product Name: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
• Synonyms: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE;TIMTEC-BB SBB006656;2-Chloro-5-(trifluoromethyl)phenyl isocyanate 97%;2-Chloro-5-(trifluoromethyl)phenylisocyanate97%;Isocyanic Acid 2-Chloro-5-(trifluoromethyl)phenyl Ester;2-Chloro-5-(trifluoromethyl)phenyl Iscyanate;1-chloro-2-isocyanato-4-(trifluoromethyl)benzene(SALTDATA: FREE);4-Chloro-3-isocyanatobenzotrifluoride, 1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene
• CAS NO: 50528-86-4
• Molecular Formula: C₈H₃ClF₃NO
• Molecular Weight: 221.56
• Product Categories: Phenyl isocyanate&Phenyl isothiocyanate;Isocyanates;Nitrogen Compounds;Organic Building Blocks
• Mol File: 50528-86-4.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 63-64 °C5 mm Hg(lit.)
• Flash Point: 198 °F
• Appearance: colorless to light yellow liquid
• Density: 1.48 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.489(lit.)
• Storage Temp.: 0-10°C
• Sensitive: Moisture Sensitive
• BRN: 2112804
• CAS DataBase Reference: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(50528-86-4)
• EPA Substance Registry System: 2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL ISOCYANATE(50528-86-4)

Safety Data

• Hazard Codes: Xn,Xi,C
• Statements: 20/21/22-36/37/38-42-20/22
• Safety Statements: 23-26-45-36/37/39
• RIDADR: UN 2206 6.1/PG 3
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 50528-86-4(Hazardous Substances Data)

Usage

Chemical Properties

colorless to light yellow liquid

Upstream product

• 32315-10-9 bis(trichloromethyl) carbonate 
• 121-50-6 3-amino-4-chlorobenzotrifluoride 

Downstream Products

• 584-81-6 N-(2-chloro-5-trifluoromethyl-phenyl)-N'-(3,4-dichloro-phenyl)-urea 
• 929274-53-3 C₁₅H₁₁ClF₃N₅O₃S 
• 929274-52-2 C₁₅H₁₁ClF₃N₅O₃ 
• 1228590-67-7 N-{6-[3-({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-7-cyano-1,3-benzothiazol-2-yl}acetamide 
• 1290546-48-3 4-(4-(3-(2-chloro-5-(trifluoromethyl)phenyl)ureido)phenoxy)-N-methylpicolinamide 

Relevant articles and documents

Synthesis and in vitro antitumor activity of novel diaryl urea derivatives

A series of novel diaryl ureas containing 4-[(2-amino-6-trifluromethyl) pyrimidine-4-yl]piperazine-1-yl group were synthesized and evaluated for their cytotoxic activities in a panel of human cancer cell lines. Compared with the reference drug Sorafenib, some compounds showed more potent and a broader spectrum of anti-cancer activities. Among them, compound 2p demonstrated significant inhibitory activities against MDA-MB-231, HT-29 and MCF-7 cell lines with IC50 values of 0.016, 0.63, 0.001 μmol/L, respectively.