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Hydrogen Peroxide → 4'-hydroxy-2,3-dihydrospiro[furo[2,3-g][1,4]benzodioxine-8,3'-indol]-2'(1'H)-one

HRID 1407912
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HRID 1407912 반응식
Br[C:2]1[CH:10]=[CH:9][CH:8]=[C:7]2[C:3]=1[C:4]1([C:22]3[C:13](=[CH:14][C:15]4[O:20][CH2:19][CH2:18][O:17][C:16]=4[CH:21]=3)[O:12][CH2:11]1)[CH2:5][NH:6]2.C([Li])(C)(C)C.B(OC)(OC)[O:29]C.OO.[OH2:37]>O1CCCC1>[OH:37][C:2]1[CH:10]=[CH:9][CH:8]=[C:7]2[C:3]=1[C:4]1([C:22]3[C:13](=[CH:14][C:15]4[O:20][CH2:19][CH2:18][O:17][C:16]=4[CH:21]=3)[O:12][CH2:11]1)[C:5](=[O:29])[NH:6]2
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 5

HCID 784Hydrogen PeroxideHCID 962WaterHCID 8470Trimethyl borateHCID 685993684'-Bromo-1,2,2',3-tetrahydrospiro[furo[2,3-g][1,4]benzodioxine-8,3'-indole]HCID 178418306HCID 178418306, 화합물

생성물 1

HCID 593523524'-hydroxy-2,3-dihydrospiro[furo[2,3-g][1,4]benzodioxine-8,3'-indol]-2'(1'H)-one
수율 2%

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매

실험 절차

To a solution of 4′-bromo-1′,2,2′,3-tetrahydrospiro[furo[2,3-g][1,4]benzodioxine-8,3′-indole] (0.30 g, 0.80 mmol) in anhydrous tetrahydrofuran (20 mL) at −98° C. was added tert-butyllithium (1.90 mL, 1.7 M solution in pentane, 3.2 mmol) and stirred for 15 min. Trimethyl borate (0.36 mL, 3.2 mmol) was added and the reaction mixture was allowed to warm to ambient temperature and stirred for 16 h. A solution of hydrogen peroxide in water (0.28 mL, 35% w/w, 3.2 mmol) was added to the reaction mixture at 0° C., and the mixture was allowed to warm to ambient temperature, stirred for 0.5 h and concentrated in vacuo. The residue was triturated with water and filtered. The resultant solid was purified by column chromatography and eluted with a 0% to 50% gradient of ethyl acetate in dichloromethane to afford 4′-hydroxy-2,3-dihydrospiro[furo[2,3-g][1,4]benzodioxine-8,3′-indol]-2′(1′H)-one (0.004 g, 2%) as a colorless solid: mp>250° C.; 1H NMR (300 MHz, DMSO-d6) δ 10.37 (s, 1H), 9.50 (s, 1H), 7.00 (dd, J=8.0, 8.0 Hz, 1H), 6.39-6.34 (m, 3H), 6.08 (s, 1H), 4.64 (ABq, 2H), 4.09 (m, 4H); 13C NMR (75 MHz, DMSO-d6) δ 179.3, 155.5, 154.1, 144.0, 143.6, 137.7, 130.1, 121.0, 116.1, 111.1, 110.5, 101.8, 98.7, 76.8, 64.6, 64.0, 57.2; MS (ES+) m/z 311.7 (M+1).

후처리

  1. stirringstirred for 16 h
  2. temperatureto warm to ambient temperature
  3. stirringstirred for 0.5 h
  4. concentrationconcentrated in vacuo
  5. customThe residue was triturated with water
  6. filtrationfiltered
  7. customThe resultant solid was purified by column chromatography
  8. washeluted with a 0% to 50% gradient of ethyl acetate in dichloromethane

출처 및 근거

ORD 기록
ord-b0e884da62704c3686a74921d41cd121
출처 데이터셋
uspto-grants-2014_12
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08916580B2

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