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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1783869생성일: 2026년 10월 25일

Water → 4,4-Dimethyl-pent-2-enoic acid methyl ester

https://huagongshe.com/reaction/1783869

반응식

참여 물질

역할이름HCID투입량
반응물WaterHCID 962—
반응물PivalaldehydeHCID 12417—
반응물Methyl diethylphosphonoacetateHCID 66113—
반응물ButyllithiumHCID 178418339—
용매TetrahydrofuranHCID 8028—
생성물4,4-Dimethyl-pent-2-enoic acid methyl esterHCID 558231—

반응 조건

온도-78 °C

반응 단계

Methyl diethylphosphonoacetate (13.35 mL, 73.6 mmol, 1.05 eq.) was dissolved in THF (30 mL) and cooled to −78° C. in an acetone-dry ice bath. n-BuLi (1.6M in hexanes) (45.8 mL, 73.2 mmol, 1.05 eq.) was added slowly over 20 min. Trimethylacetaldehyde (6.0 g, 69.6 mmol, 1.0 eq.), was added to the reaction and allowed to stir at −78° C. for 20 minutes and warmed to room temperature and stirred overnight. Water (30 mL) was added to quench and extracted with ethyl ether (3×100 mL). The combined organics were washed with brine and dried over MgSO4, filtered and evaporated to provide 4,4-Dimethyl-pent-2-enoic acid methyl ester, a colorless liquid (8.52 g, 60.0 mmol, 86%) and was used directly in the next reaction. 1H NMR (CDCl3, 400 MHz) δ 0.89 (s, 9H), 3.64 (s, 3H), 5.64 (d, 1H, J=16.0 Hz), 6.88 (d, 1H, J=16.0 Hz).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US07501408B2
출처 데이터셋uspto-grants-2009_03
ORD IDord-6c4ebff5f0044ba8a0948b33a77e2c07
출처 메모uspto-grants-2009_03