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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 882673생성일: 2026년 10월 26일

Tetrahydrofuran → Ethyl 3-(acetylthio)-3-cyanopropanoate

https://huagongshe.com/reaction/882673

반응식

참여 물질

역할이름HCID투입량
반응물TetrahydrofuranHCID 8028—
반응물2-Thiopheneacetic acidHCID 15970—
반응물DiisopropylethylamineHCID 81531—
반응물Ethyl (2Z)-3-cyanoprop-2-enoateHCID 15577688—
생성물Ethyl 3-(acetylthio)-3-cyanopropanoateHCID 5324810865%

반응 단계

(Z)-ethyl 3-cyanoacrylate (5.01 g, 40.00 mmol) in 80 ml of THF at −20° C. was added the solution of thiol acetic acid (5.0 ml, 70.15 mmol) and DIPEA (16.0 ml, 92.03 mmol) in 20 ml of THF in 30 min. The reaction was kept at −20° C. for 4 hr then room temperature overnight. The mixture was concentrated, diluted with CH2Cl2, washed with saturated NaHCO3, dried over MgSO4, filtered, evaporated and purified by SiO2 chromatography (1:4 EtAC/Hexane) to afford 5.22 g (65%) of the title compound. Rf=0.25 (1:4 EtAC/Hexane); 1H NMR (CDCl3), 4.44 (m, 1H), 4.11 (dd, 2H, J=7.1, 14.3 Hz), 3.38 (m, 1H), 3.15 (m, 1H), 2.17 (s, 3H), 1.19 (t, 3H, J=7.2 Hz); 13C NMR 194.12, 173.21, 119.82, 61.35, 33.52, 30.08, 14.62; MS m/z+ 225.9 (MW+Na), m/z− 201.7 (MW−H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08236319B2
출처 데이터셋uspto-grants-2012_08
ORD IDord-ba6cdf2b3bb44480aa7b805b882d90d0
출처 메모uspto-grants-2012_08