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HRID 495023作成日:2026年10月26日

Acetyl chloride → 2-(4-Chloro-2-fluoro-3-methoxyphenyl)-1,3,2-dioxaborinane

https://huagongshe.com/reaction/495023

反応式

関与物質

役割名称HCID仕込み量
反応物Acetyl chlorideHCID 6367—
反応物1,3-PropanediolHCID 10442—
反応物Triisopropyl borateHCID 21531—
反応物1-Bromo-4-chloro-2-fluoro-3-methoxybenzeneHCID 66600367—
反応物ButyllithiumHCID 178418339—
溶媒Diethyl EtherHCID 3283—
溶媒TetrahydrofuranHCID 8028—
生成物2-(4-Chloro-2-fluoro-3-methoxyphenyl)-1,3,2-dioxaborinaneHCID 57782419144.2%

反応条件

温度0 °C

反応手順

To a solution of 1-bromo-4-chloro-2-fluoro-3-methoxybenzene (10.4 g, 0.043 mol) in diethyl ether (150 mL) at −78° C. was slowly added n-butyl lithium (2.5M, 19.0 mL, 0.0475 mol), and the solution was stirred for thirty minutes. A solution of triisopropyl borate (12.0 g, 0.064 mL) in THF (25 mL) was slowly added and the solution warmed to 0° C. Acetyl chloride (10.0 g, 0.13 mol) was added. After stirring for one hour the solution was concentrated and the solid residue was partitioned between ethyl acetate (150 mL) and 1N sodium hydroxide (50 mL). Ice was added to the aqueous phase that was subsequently acidified with sufficient concentrated hydrochloric acid to obtain a pH of 2. The heterogeneous mixture was extracted with ethyl acetate (2×150 mL) and the combined organic phases were dried and concentrated. The resulting solid was slurried in toluene, propane-1,3-diol (6.6 g, 0.09 mol) was added, and the resulting mixture was heated under reflux to remove water via a Dean-Stark trap. After two hours, the mixture was allowed to cool and was concentrated under vacuum. The resulting oil was dissolved in methylene chloride (50 mL), washed with water (25 mL), dried, and concentrated to give 2-(4-chloro-2-fluoro-3-methoxyphenyl)-[1,3,2]-dioxaborinane (6.4 g, 0.062 mol): 1H NMR (CDCl3): δ 7.15 (m, 1H), 6.95 (dd, 1H), 4.05 (t, 4H), 3.8 (s, 3H), 1.95 (t, 2H).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US07538214B2
出典データセットuspto-grants-2009_05
ORD IDord-5c9b2a5e02f248e38a8b6288b8bc7fb9
出典メモuspto-grants-2009_05