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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 387481생성일: 2026년 10월 25일

2,2-Difluoro-1,3-benzodioxole-5-carbonyl chloride → 2,2-Difluoro-N-{5-[4-(pyridin-3-yloxy)phenyl]-1,3,4-oxadiazol-2-yl}-1,3-benzodioxole-5-carboxamide

https://huagongshe.com/reaction/387481

반응식

참여 물질

역할이름HCID투입량
반응물2,2-Difluoro-1,3-benzodioxole-5-carbonyl chlorideHCID 2774064—
반응물5-[4-(Pyridin-3-yloxy)phenyl]-1,3,4-oxadiazol-2-amine hydrobromide saltHCID 68679658—
용매MethanolHCID 887—
용매PyridineHCID 1049—
생성물2,2-Difluoro-N-{5-[4-(pyridin-3-yloxy)phenyl]-1,3,4-oxadiazol-2-yl}-1,3-benzodioxole-5-carboxamideHCID 5913545612.3%

반응 단계

5-[4-(Pyridin-3-yloxy)phenyl]-1,3,4-oxadiazol-2-amine hydrobromide salt (167.5 mg, 0.5 mmol) was suspended in 2 mL of anhydrous pyridine. Neat 2,2-difluoro-1,3-benzodioxole-5-carbonyl chloride (165.4 mg, 0.75 mmol) was added directly into the solution. The reaction mixture formed an orange-red solution with a small amount of white precipitate. It was left to stir for 3 hours. Then it was diluted with ca. 1 mL of MeOH, filtered through 0.22 u syringe filter and purified by reverse phase preparative HPLC using acetonitrile/water mixture containing 0.01% of TFA. Fractions, containing the product, were combined and partitioned between ca. 40 mL of EtOAc and ca. 40 mL of saturated aqueous NaHCO3. The EtOAc layer was washed with brine, dried over anhydrous sodium sulfate and filtered. Solvent was removed in vacuo to give the title product as a yellow solid (27.0 mg). Yield 12.3%.

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US08372971B2
출처 데이터셋uspto-grants-2013_02
ORD IDord-d25e1e59550a497c961035ec60f8b910
출처 메모uspto-grants-2013_02