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HRID 1184658作成日:2026年10月26日

Water → 3-Pyridinecarbonitrile, 6-(chlorodifluoromethyl)-

https://huagongshe.com/reaction/1184658

反応式

関与物質

役割名称HCID仕込み量
反応物WaterHCID 962—
反応物3-(Dimethylamino)prop-2-enenitrileHCID 97497—
反応物Ammonium AcetateHCID 517165—
反応物4-Ethoxy-1-chloro-1,1-difluoro-3-butene-2-oneHCID 5796722—
溶媒TolueneHCID 1140—
生成物3-Pyridinecarbonitrile, 6-(chlorodifluoromethyl)-HCID 1094324741.1%

反応条件

温度100 °C

反応手順

(3E)-1-Chloro-4-ethoxy-1,1-difluorobut-3-en-2-one (7.36 g, 40 mmol) was dissolved in dry toluene (40 mL) and treated with 3-dimethylaminoacrylonitrile (4.61 g, 48 mmol) at room temperature. The solution was heated at about 100° C. for 3.5 hr. The solvent was then removed under reduced pressure and the remaining mixture was re-dissolved in DMF (20 mL), treated with ammonium acetate (4.62 g, 60 mmol) and stirred at room temperature overnight. Water was added to the reaction mixture and the resulting mixture was extracted with ether-CH2CH2 (1:2, v/v) twice. The combined organic layer was washed with brine, dried, filtered and concentrated. The residue was purified on silica gel to give 3.1 g of 6-[chloro(difluoro)methyl]nicotinonitrile (A) as light colored oil in 41% yield. GC-MS: mass calcd for C7H3ClF2N2 [M]+ 188. Found 188.

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US08669278B2
出典データセットuspto-grants-2014_03
ORD IDord-df96c01abb2f455b9a6e9d981eb3711f
出典メモuspto-grants-2014_03