돌아가기
Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 907662생성일: 2026년 10월 26일

Toluene → Ethyl 4-(4'-nitro-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate

https://huagongshe.com/reaction/907662

반응식

참여 물질

역할이름HCID투입량
반응물TolueneHCID 1140—
반응물Sodium CarbonateHCID 10340—
반응물4-Nitrophenylboronic acidHCID 2773552—
반응물Ethyl 4-(4-bromophenyl)-4-oxo-2-(2-phenylethyl)butanoateHCID 21985805—
용매1,4-DioxaneHCID 31275—
생성물Ethyl 4-(4'-nitro-1,1'-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoateHCID 2198573775.2%

반응 조건

온도85 °C

반응 단계

Ethyl 4-(4-bromophenyl)-4-oxo-2-(2-phenylethyl)butanoate (4.32 g, 11.1 mmol) and 4-nitrophenylboronic acid (2.22, 13.3 mmol) was added to a dry flask under argon. Toluene (100 mL), dioxane (25 mL), saturated aqueous sodium carbonate (30 mL), and [1,1′-bis(diphenyl-phosphino)-ferrocene]dichloro palladium(II) (1:1 complex with dichloromethane, 453 mg, 0.55 mmol) were added and the mixture was thoroughly degassed. The resulting mixture was then heated at 85° C. for 16 h before it was cooled to rt. Water was added and the mixture was extracted twice with ethyl acetate. The combined extracts were dried over anhydrous sodium sulfate and concentrated under reduced pressure. The residue was purified by flash chromatography (Biotage flash 75, 5:1 ethyl acetate/hexane) to afford ethyl 4-(4′-nitro-1,1′-biphenyl-4-yl)-4-oxo-2-(2-phenylethyl)butanoate (3.6 g, 75%). HPLC ret. time 3.99 min, 1H NMR (300 MHz, CDCl3) δ 1.29 (t, 3H), 1.85-2.08 (m, 2H), 2.71 (t, 2H), 3.05-3.20 (m, 2H), 3.45-3.52 (m, 1H), 4.20 (q, 2H), 7.18-7.31 (m, 5H), 7.72 (d, 2H), 7.78 (d, 2H), 8.05 (d, 2H), 8.33 (d, 2H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08013166B2
출처 데이터셋uspto-grants-2011_09
ORD IDord-c90aa6d5402f49858f19dfbbd0cc66d5
출처 메모uspto-grants-2011_09