713-45-1

Basic information

• Product Name: 1-(4-(trifluoroMethyl)phenyl)propan-2-one
• Synonyms: 1-(4-(trifluoroMethyl)phenyl)propan-2-one;4-(trifluoromethyl)phenylacetone
• CAS NO: 713-45-1
• Molecular Formula: C₁₀H₉F₃O
• Molecular Weight: 202.1730696
• Mol File: 713-45-1.mol
• Article Data: 18

Chemical Properties

• Boiling Point: 214.982°C at 760 mmHg
• Flash Point: 95.755°C
• Appearance: /
• Density: 1.194g/cm³
• Vapor Pressure: 0.151mmHg at 25°C
• Refractive Index: 1.449
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 1-(4-(trifluoroMethyl)phenyl)propan-2-one(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(4-(trifluoroMethyl)phenyl)propan-2-one(713-45-1)
• EPA Substance Registry System: 1-(4-(trifluoroMethyl)phenyl)propan-2-one(713-45-1)

Safety Data

• Hazardous Substances Data: 713-45-1(Hazardous Substances Data)

Usage

Uses

1-[4-(Trifluoromethyl)phenyl]propan-2-one is used in the preparation and catalytic activity of a highly congested carbazoyl-derived P,N-type phosphine ligand for the Pd-catalyzed acetone monoarylations.

InChI:InChI=1/C10H9F3O/c1-7(14)6-8-2-4-9(5-3-8)10(11,12)13/h2-5H,6H2,1H3

Upstream product

• 402-43-7 p-trifluoromethylphenyl bromide 
• 75-56-9 methyloxirane 
• 402-51-7 4-(trifluoromethyl)phenylmagnesium bromide 
• 78-95-5 chloroacetone 
• 42006-43-9 (E)-1-(prop-1-en-1-yl)-4-(trifluoromethyl)benzene 
• 79756-87-9 1-(prop-1-ynyl)-4-trifluoromethylbenzene 
• 108-22-5 Isopropenyl acetate 
• 1833-53-0 2-(Trimethylsilyloxy)propene 
• 123-54-6 acetylacetone 
• 455-13-0 4-Iodobenzotrifluoride 
• 67-64-1 acetone 
• 98-56-6 4-chlorobenzotrifluoride 
• 455-14-1 4-trifluoromethylphenylamine 
• 1813-97-4 1-allyl-4-(trifluoromethyl)benzene 

Downstream Products

• 14276-90-5 2-Methyl-1-(p-trifluormethylphenyl)-2-butanol 
• 185557-06-6 5-Hydroxy-5-methyl-4-(4-trifluoromethyl-phenyl)-5H-furan-2-one 
• 274915-12-7 3-[2-oxo-1-(4-trifluoromethylphenyl)propyl]-4-ethoxycyclobut-3-ene-1,2-dione 
• 864370-26-3 6-methyl-4-methylsulfanyl-2-oxo-5-(4-trifluoromethyl-phenyl)-2H-pyran-3-carbonitrile 
• 185557-18-0 6-Chloro-3-methyl-4-(4-trifluoromethyl-phenyl)-pyridazine 
• 185557-12-4 6-Methyl-5-(4-trifluoromethyl-phenyl)-2H-pyridazin-3-one 
• 79287-56-2 5-(7-Chloro-quinolin-4-ylamino)-3-diethylaminomethyl-4'-trifluoromethyl-biphenyl-2-ol 
• 79287-58-4 5-(7-Chloro-1-oxy-quinolin-4-ylamino)-3-diethylaminomethyl-4'-trifluoromethyl-biphenyl-2-ol 
• 79287-57-3 3-(tert-Butylamino-methyl)-5-(7-chloro-quinolin-4-ylamino)-4'-trifluoromethyl-biphenyl-2-ol; hydrochloride 
• 14276-93-8 2-Methyl-1-(p-trifluormethylphenyl)-butan 
• 864878-71-7 2-methyl-1-(4-(trifluoromethyl)phenyl)propan-2-ol 
• 1309380-75-3 1-(p-trifluoromethylphenyl)-2-propanone oxime 
• 1262155-48-5 C₂₀H₁₆F₃NO₃S 
• 1333377-94-8 1,2-di-p-tolyl-3-(4-(trifluoromethyl)phenyl)pentane-1,4-dione 

Relevant articles and documents

A facile, microwave-assisted, palladium-catalyzed arylation of acetone

We report an expedient method for the heteroarylation of acetone under tin-free conditions. The coupling is performed using the commercially available enol silane of acetone (2-trimethylsilyloxypropene) and a corresponding aryl bromide, chloride or triflate under microwave-assisted conditions, with tris(dibenzylideneacetone)dipalladium (Pd2(dba)3) or palladium acetate (Pd(OAc)2) and 2-(2′,6′-dimethoxybiphenyl)dicyclohexylphosphine (S-Phos) as the catalyst system.

Aryl C-F bond functionalization preparation method

The invention relates to the technical field of organic compound synthesis, in particular to an aryl C-F bond functionalization preparation method. A fluorobenzene compound and a nucleophilic reagent react under the action of a composite catalyst, wherein the composite catalyst is formed by mixing a visible light catalyst and a metal catalyst. The photocatalyst is adopted, the reaction process is safe and controllable, and operation in the preparation and production process is simplified; a purple LED is used as a reaction energy source and is green and environment-friendly, the energy utilization rate is high, and conversion from light energy to chemical energy can be efficiently realized; in the reaction, a simple nucleophilic reagent is used for attacking free radical cation species generated under a visible light catalysis condition, so that a target product with an extremely wide range is efficiently and greenly prepared; the operation steps are simplified, and the reaction route is shortened; and moreover, the forward reaction rate is high, and the production efficiency is remarkably improved.

Nickel-Catalyzed Mono-Selective α-Arylation of Acetone with Aryl Chlorides and Phenol Derivatives

The challenging nickel-catalyzed mono-α-arylation of acetone with aryl chlorides, pivalates, and carbamates has been achieved for the first time. A nickel/Josiphos-based catalytic system is shown to feature unique catalytic behavior, allowing the highly selective formation of the desired mono-α-arylated acetone. The developed methodology was applied to a variety of (hetero)aryl chlorides including biologically relevant derivatives. The methodology has been extended to the unprecedented coupling of acetone with phenol derivatives. Mechanistic studies allowed the isolation and characterization of key Ni0 and NiII catalytic intermediates. The Josiphos ligand is shown to play a key role in the stabilization of NiII intermediates to allow a Ni0/NiII catalytic pathway. Mechanistic understanding was then leveraged to improve the protocol using an air-stable NiII pre-catalyst.