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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1483733생성일: 2026년 10월 25일

Cesium carbonate → 6-(1-Hydroxy-1,3-dihydro-benzo[c][1,2]oxaborol-5-yloxy)-5-methoxymethoxy-nicotinonitrile

https://huagongshe.com/reaction/1483733

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참여 물질

역할이름HCID투입량
반응물Cesium carbonateHCID 10796—
반응물1,3-Dihydro-1-hydroxy-2,1-benzoxaborol-5-olHCID 57968699—
반응물6-Chloro-5-methoxymethoxy-nicotinonitrileHCID 86636456—
용매DimethylformamideHCID 6228—
생성물6-(1-Hydroxy-1,3-dihydro-benzo[c][1,2]oxaborol-5-yloxy)-5-methoxymethoxy-nicotinonitrileHCID 6743966040%

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온도80 °C

반응 단계

To a mixture of 6-chloro-5-methoxymethoxy-nicotinonitrile (0.68 g, 3.42 mmol) and 3H-benzo[c][1,2]oxaborole-1,5-diol (0.56 g, 3.76 mmol) in DMF (10 mL) was added cesium carbonate (2.45 g, 7.52 mmol). The resulting suspension was heated at 80° C. for overnight. DMF was removed under reduced pressure, the residue was diluted with EtOAc (50 mL), washed with water (10 mL) and brine (10 mL), dried over Na2SO4, filtered, and concentrated to give brown oil. Purification was accomplished by flash chromatography on silica gel using 1-100% MeOH/EtOAc gradient elution to yield the title compound (0.40 g, 40%) as a transparent oil. 1H NMR (400 MHz, DMSO-d6) δ ppm 9.23 (s, 1H), 8.24 (s, 1H), 8.03 (s, 1H), 7.77 (d, J=8.6 Hz, 1H), 7.23 (s, 1H), 7.14 (d, J=7.4 Hz, 1H), 5.40 (s, 2H), 4.98 (s, 2H), 3.45 (s, 3H); MS (ES) m/z: 313 (M+1)+.

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US09416146B2
출처 데이터셋uspto-grants-2016_08
ORD IDord-bb1b8e7720734227860b609fd18144d7
출처 메모uspto-grants-2016_08