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HRID 516780作成日:2026年10月26日

Dimethylformamide → methyl 6-cyano-1-isopropyl-3-methyl-1H-indole-4-carboxylate

https://huagongshe.com/reaction/516780

反応式

関与物質

役割名称HCID仕込み量
反応物DimethylformamideHCID 6228—
反応物Sodium CarbonateHCID 10340—
反応物methyl 6-bromo-1-isopropyl-3-methyl-1H-indole-4-carboxylateHCID 67464634—
反応物HCID 178514179HCID 178514179—
触媒HCID 178418397HCID 178418397—
溶媒Ethyl AcetateHCID 8857—
生成物methyl 6-cyano-1-isopropyl-3-methyl-1H-indole-4-carboxylateHCID 6746728138.9%

反応手順

To a 10 ml microwave vial was added methyl 6-bromo-3-methyl-1-(1-methylethyl)-1H-indole-4-carboxylate (500 mg, 1.612 mmol), dicyanozinc (150 mg, 1.277 mmol) and DMF (5 mL). The mixture was degassed and stirred at rt under N2 for 15 min. To the mixture was added palladium tetrakis (118 mg, 0.102 mmol) and the reaction was stirred at 95° C. for 1 h. The reaction was allowed to cool and poured into saturated aqueous Na2CO3 (50 mL) and EtOAc (50 mL) and stirred for 20 min. The mixture was extracted with ether (100 ml) and EtOAc (100 ml) (1:1), followed by filtration and evaporation to yield a residue. The residue was purified by silica gel chromatography (Analogix IF280, 0-8% EtOAc/hexanes, SF25-40 g, 30 minutes) to give methyl 6-cyano-3-methyl-1-(1-methylethyl)-1H-indole-4-carboxylate (130 mg, 0.497 mmol, 38.9% yield) as a white solid. 1H NMR (400 MHz, DMSO-d6) δ ppm 8.38 (d, J=1.52 Hz, 1H) 7.82 (s, 1H) 7.71 (d, J=1.52 Hz, 1H) 4.85-4.97 (m, 1H) 3.90 (s, 3H) 2.29 (s, 3H) 1.45 (d, J=6.57 Hz, 6H). MS(ES) [M+H]+ 257.4.

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US09114141B2
出典データセットuspto-grants-2015_08
ORD IDord-5553fa390c024d5882f969f93ad9b8f8
出典メモuspto-grants-2015_08