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HRID 14082作成日:2026年10月23日

Sodium Carbonate → 3-Isopropenylbenzonitrile

https://huagongshe.com/ja/reaction/14082

反応式

関与物質

役割名称HCID仕込み量
反応物Sodium CarbonateHCID 10340—
反応物2-BromopropeneHCID 11202—
反応物3-Cyanophenylboronic acidHCID 2734325—
触媒HCID 178418397HCID 178418397—
溶媒WaterHCID 962—
溶媒1,2-DimethoxyethaneHCID 8071—
生成物3-IsopropenylbenzonitrileHCID 12180250—

反応手順

To a stirred solution of 3-cyanophenylboronic acid (10.0 g, 68.05 mmol) dissolved in DME (340 mL) is added 2-bromopropene (6.86 g, 56.7 mmol), and sodium carbonate (62.3 mL of a 2 M solution in water, 124.7 mmol). The reaction mixture is degassed for 20 min with nitrogen. Tetrakis(triphenylphosphine)palladium(0) (2.54 g, 2.2 mmol) is added, the reaction mixture degassed for 10 min, and heated at reflux overnight. The reaction mixture is cooled to room temperature and then partitioned between hexanes and water. The aqueous layer is extracted with hexanes (3×75 mL). The combined organic layers are washed with brine, dried (magnesium sulfate), filtered, and concentrated under reduced pressure. Purification by flash column chromatography (9:1 hexanes/ethyl acetate) provides the title compound. 1H NMR (300 MHz, DMSO-d6) δ 7.96 (m, 1H), 7.85 (d, J=8 Hz, 1H), 7.75 (d, J=8 Hz, 1H), 7.56 (m, 1H) 5.58 (s, 1H), 5.23 (m, 1H), 2.13 (s, 3H).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US07727997B2
出典データセットuspto-grants-2010_06
ORD IDord-f63263e9904849a6be8ce23d03fbe3dc
出典メモuspto-grants-2010_06