85068-30-0

Basic information

• Product Name: 2',4'-Difluoropropiophenone
• Synonyms: 2',4'-DIFLUOROPROPIOPHENONE;2,4-DIFLUOROPROPIOPHENONE;1-(2,4-DIFLUOROPHENYL)-1-PROPANONE;2,4-DEFLUOROPROPIOPHENONE;2',4'-Difluoropropiophenone 97%;2',4'-Difluoropropiophenone97%;1-(2,4-difluorophenyl)propan-1-one;1-Propanone, 1-(2,4-difluorophenyl)-
• CAS NO: 85068-30-0
• Molecular Formula: C₉H₈F₂O
• Molecular Weight: 170.16
• EINECS: 285-291-4
• Product Categories: Aromatic Propiophenones (substituted);Adehydes, Acetals & Ketones;Fluorine Compounds
• Mol File: 85068-30-0.mol

Chemical Properties

• Boiling Point: 51-52 °C (1.5 mmHg)
• Flash Point: 76 °C
• Appearance: Clear colorless to light yellow/Liquid
• Density: 1.193 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.311mmHg at 25°C
• Refractive Index: 1.4835-1.4855
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility: Insoluble
• BRN: 7633370
• CAS DataBase Reference: 2',4'-Difluoropropiophenone(CAS DataBase Reference)
• NIST Chemistry Reference: 2',4'-Difluoropropiophenone(85068-30-0)
• EPA Substance Registry System: 2',4'-Difluoropropiophenone(85068-30-0)

Safety Data

• Hazard Codes: Xi,T
• Statements: 36/37/38-36/37
• Safety Statements: 37/39-26-36-36/37-36/37/39
• HazardClass: IRRITANT
• Hazardous Substances Data: 85068-30-0(Hazardous Substances Data)

Usage

Chemical Properties

CLEAR COLOURLESS TO LIGHT YELLOW LIQUID

InChI:InChI=1/C9H8F2O/c1-6(12)4-7-2-3-8(10)5-9(7)11/h2-3,5H,4H2,1H3

Upstream product

• 67-56-1 methanol 
• 2267-47-2 1-(2,4-difluorophenyl)ethan-1-ol 
• 364-83-0 2',4'-difluoroacetophenone 
• 372-18-9 1,3-Difluorobenzene 
• 79-03-8 propionyl chloride 

Downstream Products

• 173190-46-0 2',4'-difluoro-2-methyl-3-(4-cyanophenyl)-propiophenone 
• 907186-46-3 [[2-(2,4-difluorophenyl)-1-methyl-2-(4-morpholinyl)ethenyl]-imino]propanedinitrile 
• 907186-26-9 5-(2,4-difluorophenyl)-3,4-dihydro-3-imino-6-methyl-4-(2-methylbutyl)pyrazine-2-carbonitrile 
• 1214269-01-8 2,4-difluoro-1-(1-methylene-propyl)benzene 
• 1616866-77-3 thiocyanic acid 2-(2,4-difluorophenyl)-1-methyl-2-oxoethyl ester 
• 1616865-37-2 N-(2-bromo-4,6-dichlorophenyl)-4-methyl-2-bromo-5-(2,4-difluorophenyl)-1H-imidazol-1-amine 
• 1616865-35-0 5-(2,4-difluorophenyl)-N-(2,4-dichlorophenyl)-4-methyl-1H-imidazol-1-amine 
• 1616866-79-5 1-[(2,4-dichlorophenyl)amino]-5-(2,4-difluorophenyl)-1,3-dihydro-4-methyl-2H-imidazole-2-thione 
• 135206-83-6 2-bromo-1-(2,4-difluorophenyl)-1-propanone 
• 1428228-98-1 C₁₃H₁₂F₂O₄ 
• 1428229-05-3 C₁₄H₁₄F₂N₂O₂ 
• 1428228-51-6 C₁₈H₁₆F₂N₄O 
• 231958-06-8 4'-fluoro-2'-methoxypropiophenonne 
• 224048-17-3 1-cyclohexyl-3-ethyl-6-fluoro-1H-indazole 

Relevant articles and documents

Iridium Complexes as Efficient Catalysts for Construction of α-Substituted Ketones via Hydrogen Borrowing of Alcohols in Water

Ketones are of great importance in synthesis, biology, and pharmaceuticals. This paper reports an iridium complexes-catalyzed cross-coupling of alcohols via hydrogen borrowing, affording a series of α-alkylated ketones in high yield (86 %–95 %) and chemoselectivities (>99 : 1). This methodology has the advantages of low catalyst loading (0.1 mol%) and environmentally benign water as the solvent. Studies have shown the amount of base has a great impact on chemoselectivities. Meanwhile, deuteration experiments show water plays an important role in accelerating the reduction of the unsaturated ketones intermediates. Remarkably, a gram-scale experiment demonstrates this methodology of iridium-catalyzed cross-coupling of alcohols has potential application in the practical synthesis of α-alkylated ketones.

DMF Dimethyl Acetal as Carbon Source for α-Methylation of Ketones: A Hydrogenation-Hydrogenolysis Strategy of Enaminones

A novel heterogeneous catalytic hydrogenation-hydrogenolysis strategy has been developed for the α-methylation of ketones via enaminones using DMF dimethyl acetal as carbon source. This strategy provides a very convenient route to α-methylated ketones using a variety of ketones without any base or oxidant. (Chemical Equation Presented).

Total chiral synthesis of azole antifungals via α-hydroxylation of ketones

The use of camphorsulfonyl oxaziridines for the preparation of 2',4'-difluoro-(R)-2-hydroxypropiophenone, (2), a key intermediate for the synthesis of azole antifungals Sch 42427 and ER-30346 (1) in excellent enantiomeric excess and high chemical yield is described.

Preparation of chiral hydroxyketones

A process for preparing an hydroxyketone of the formula (X): STR1 wherein Ar represents substituted phenyl, aromatic heterocyclic, or substituted aromatic heterocyclic; R1 and R2 independently represents hydrogen, C-1 to C-16 alkyl, aromatic, substituted aromatic, aromatic heterocyclic, substituted aromatic heterocyclic or C-1 to C-5 alkyl covalently bonded to Ar, with the provision that R1 and R2 are different. The process comprises contacting a compound of the formula (V): STR2 with a solvent, a base and a chiral hydroxylating agent at a temperature of about -85° C. or less. Compounds of the formulae STR3 also are disclosed.