106376-16-3

Basic information

• Product Name: Benzoic acid, 4-(trifluoromethyl)-, phenyl ester
• Synonyms: 4-(trifluoromethyl)benzoate;phenyl 4-(trifluoromethyl)benzoate;4-Trifluoromethyl-benzoic acid phenyl ester;phenyl 4-trifluoromethylbenzoate
• CAS NO: 106376-16-3
• Molecular Formula: C14H9F3O2
• Molecular Weight: 266.219
• Mol File: 106376-16-3.mol
• Article Data: 25

Chemical Properties

• Melting Point: 90.4 °C
• CAS DataBase Reference: Benzoic acid, 4-(trifluoromethyl)-, phenyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: Benzoic acid, 4-(trifluoromethyl)-, phenyl ester(106376-16-3)
• EPA Substance Registry System: Benzoic acid, 4-(trifluoromethyl)-, phenyl ester(106376-16-3)

Safety Data

• Hazardous Substances Data: 106376-16-3(Hazardous Substances Data)

Upstream product

• 98-80-6 phenylboronic acid 
• 108-95-2 phenol 
• 17696-62-7 Phenyl 4-hydroxybenzoate 
• 1441984-36-6 1,3-dioxoisoindolin-2-yl 4-(trifluoromethyl)benzoate 
• 455-24-3 4-trifluoromethylbenzoic acid 
• 402-43-7 p-trifluoromethylphenyl bromide 
• 64-18-6 formic acid 
• 455-13-0 4-Iodobenzotrifluoride 
• 81290-20-2 (trifluoromethyl)trimethylsilane 
• 455-19-6 4-Trifluoromethylbenzaldehyde 
• 2751-90-8 tetraphenylphosphonium bromide 
• 1864-94-4 phenyl formate 
• 349-95-1 4-(trifluoromethyl)benzylic alcohol 
• 201230-82-2 carbon monoxide 

Downstream Products

• 144406-22-4 S-phenyl 4-trifluoromethylbenzenecarbothioate 
• 6140-17-6 4-methylbenzotrifluoride 
• 256475-07-7 (2-methoxyphenyl)[4-(trifluoromethyl)phenyl]methanone 
• 711-33-1 4-trifluoromethyl propiophenone 
• 86487-19-6 tributyl(4-(trifluoromethyl)phenyl)stannane 
• 21221-91-0 4,4'-bis(trifluoromethyl)benzophenone 
• 6185-76-8 (4-methoxyphenyl)(4-(trifluoromethyl)phenyl)methanone 
• 728-86-9 phenyl[4-(trifluoromethyl)phenyl]methanone 
• 98-08-8 α,α,α-trifluorotoluene 
• 214360-65-3 4-trifluoromethylphenylboronic acid pinacol ester 
• 501374-30-7 5,5-dimethyl-2-(4-trifluoromethyl-phenyl)-[1,3,2]dioxaborinane 
• 339-59-3 4-(trifluoromethyl)benzoic acid hydrazide 
• 53451-87-9 phenyl(4-trifluoromethylphenyl)amine 
• 347-80-8 N-phenyl 4-trifluoromethylbenzamide 

Relevant articles and documents

Benzene-1,3,5-triyl triformate (TFBen): a convenient, efficient, and non-reacting CO source in carbonylation reactions

Benzene-1,3,5-triyl triformate (TFBen) as a kind of convenient and efficient CO source has been prepared for the first time. The character of TFBen as potent and non-reacting CO source has been proven by the successful synthetic applications in carbonylation reactions. Phloroglucinol (1,3,5-trihydroxybenzene) is abundant and naturally occurring has been applied as the reusable material for TFBen synthesis.

Copper-catalysed synthesis of trifluoromethyl(hetero)arenes from di(hetero)aryl-λ3-iodanes

An efficient synthesis of trifluoromethylated (hetero)arenes has been achieved through the regioselective copper-catalyzed trifluoromethylation of di(hetero)aryl-λ3-iodanes, employing readily available trifluoromethyltrimethylsilane. The reaction works well for both symmetrical and unsymmetrical di(hetero)aryl-λ3-iodanes with good regioselectivity and also tolerates diverse functional groups such as bromo, iodo, cyano, nitro, ester, ketone and enolizable ketone.

Hydrogen-bond-assisted transition-metal-free catalytic transformation of amides to esters

The amide C-N cleavage has drawn a broad interest in synthetic chemistry, biological process and pharmaceutical industry. Transition-metal, luxury ligand or excess base were always vital to the transformation. Here, we developed a transition-metal-free hydrogen-bond-assisted esterification of amides with only catalytic amount of base. The proposed crucial role of hydrogen bonding for assisting esterification was supported by control experiments, density functional theory (DFT) calculations and kinetic studies. Besides broad substrate scopes and excellent functional groups tolerance, this base-catalyzed protocol complements the conventional transition-metal-catalyzed esterification of amides and provides a new pathway to catalytic cleavage of amide C-N bonds for organic synthesis and pharmaceutical industry. [Figure not available: see fulltext.]

Method for preparing diaryl ester compound through efficient catalysis of pyridine palladium

The invention discloses a method for preparing a diaryl ester compound through efficient catalysis of pyridine palladium. The method is used for high-efficiency high-yield preparation of the diaryl ester compound under mild conditions by taking a phenol compound, an iodobenzene compound and carbon monoxide as raw materials, triethylamine as alkali and pyridine palladium as a catalyst. The method provided by the invention has the advantages of less usage amount of the palladium catalyst, high catalytic activity of the palladium catalyst, stability of the palladium catalyst to air, simple operation, short reaction time and high atom economy, opens up a low-cost, green and efficient way for preparation of diaryl ester compounds, and has broad application prospects.