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HRID 1734607作成日:2026年10月25日

Toluene → 2-Amino-6-methyl-5-(3-fluoro-5-trifluoromethylphenyl)benzonitrile

https://huagongshe.com/reaction/1734607

反応式

関与物質

役割名称HCID仕込み量
反応物TolueneHCID 1140—
反応物Sodium CarbonateHCID 10340—
反応物3-Fluoro-5-(trifluoromethyl)benzeneboronic acidHCID 2783192—
反応物6-Amino-3-bromo-2-methylbenzonitrileHCID 22465737—
触媒HCID 178418397HCID 178418397—
溶媒EthanolHCID 702—
溶媒WaterHCID 962—
生成物2-Amino-6-methyl-5-(3-fluoro-5-trifluoromethylphenyl)benzonitrileHCID 54568840103%

反応条件

温度80 °C

反応手順

Under a dry nitrogen atmosphere, 0.5 gram (0.0004 mole) of tetrakis(triphenylphosphine)palladium(0) was added to a stirred mixture of 2.8 grams (0.0132 mole) of 2-amino-5-bromo-6-methylbenzonitrile (prepared as in Step C of Example 1), 35 mL of aqueous 2M sodium carbonate and 50 mL of toluene. To this was then added dropwise a solution of 3.3 grams (0.0159 mole) of 3-fluoro-5-trifluoromethylphenylboronic acid in 10 mL of ethanol. Upon completion of addition, the reaction mixture was warmed to about 80° C., where it was stirred for seven hours. After this time the reaction mixture was poured into 200 mL of water. The mixture was then extracted with four 100 mL portions of ethyl acetate. The combined extracts were dried with magnesium sulfate and filtered. The filtrate was concentrated under reduced pressure to a residue. The residue was subjected to column chromatography on silica gel. Elution was accomplished with methylene chloride. The product-containing fractions were combined and concentrated under reduced pressure, yielding 4.0 grams of 2-amino-6-methyl-5-(3-fluoro-5-trifluoromethylphenyl)benzonitrile, mp 96°-97° C. The NMR spectrum was consistent with the proposed structure.

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US05534518
出典データセットuspto-grants-1996_07
ORD IDord-36e7851f31f540eab3e5b750ffdf9278
出典メモuspto-grants-1996_07