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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 516780생성일: 2026년 10월 26일

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

https://huagongshe.com/reaction/516780

반응식

참여 물질

역할이름HCID투입량
반응물DimethylformamideHCID 6228—
반응물Sodium CarbonateHCID 10340—
반응물methyl 6-bromo-1-isopropyl-3-methyl-1H-indole-4-carboxylateHCID 67464634—
반응물HCID 178514179HCID 178514179—
촉매HCID 178418397HCID 178418397—
용매Ethyl AcetateHCID 8857—
생성물methyl 6-cyano-1-isopropyl-3-methyl-1H-indole-4-carboxylateHCID 6746728138.9%

반응 단계

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.

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US09114141B2
출처 데이터셋uspto-grants-2015_08
ORD IDord-5553fa390c024d5882f969f93ad9b8f8
출처 메모uspto-grants-2015_08