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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 885734생성일: 2026년 10월 27일

Carbon Dioxide → 3-Bromo-2-fluoro-5-methylbenzoic acid

https://huagongshe.com/reaction/885734

반응식

참여 물질

역할이름HCID투입량
반응물Carbon DioxideHCID 280—
반응물DiisopropylamineHCID 7912—
반응물3-Bromo-4-fluorotolueneHCID 96745—
반응물ButyllithiumHCID 178418339—
용매TetrahydrofuranHCID 8028—
생성물3-Bromo-2-fluoro-5-methylbenzoic acidHCID 1251347185%

반응 조건

온도-10 °C

반응 단계

To a solution of diisopropylamine (1.8 mL, 12.7 mmol) in THF (20 mL) at −10° C., n-BuLi (0.68 g, 10.6 mmol) was added and the reaction was stirred for 1 hour at −10° C. and was then cooled to −78° C. A solution of 2-bromo-1-fluoro-4-methylbenzene (2.0 g, 10.6 mmol) in THF (10 mL) was added in dropwise and the reaction was stirred for 1 hour after which excess solid carbon dioxide (4.76 g, 106 mmol) was added. After 30 minutes the reaction mixture was allowed to warm to room temperature, allowing for pressure release, and was quenched with water. The resulting layers were separated and the aqueous portion was extracted with Et2O. The aqueous layer was then acidified with aqueous 6.0 M HCl solution and the resulting white precipitate was extracted into Et2O. The combined organic portions were dried (MgSO4), and concentrated in vacuo to afford 3-bromo-2-fluoro-5-methylbenzoic acid (2.1 g, 9.0 mmol, 85%) as a white solid: 1H NMR (300 MHz, CDCl3) δ 2.37 (s, 3H) 7.60 (dd, J=5.9, 1.8 Hz, 1H) 7.75 (dd, J=6.2, 1.8 Hz, 1H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08242260B2
출처 데이터셋uspto-grants-2012_08
ORD IDord-574c3293106d4e168fbc6261eb96b2a8
출처 메모uspto-grants-2012_08