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Benzyl Bromide → HCID 58557870、化合物

HRID 1969865
ノート
印刷プレビュー

反応式

HRID 1969865 の反応式
[C:1]([O:5][C:6]([NH:8][C:9]12[CH2:16][CH2:15][C:12]([C:17]([O:19][CH3:20])=[O:18])([CH2:13][CH2:14]1)[CH2:11][CH2:10]2)=[O:7])([CH3:4])([CH3:3])[CH3:2].[H-].[Na+].[CH2:23](Br)[C:24]1[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=1>CN(C=O)C.CCCC[N+](CCCC)(CCCC)CCCC.[I-]>[CH2:23]([N:8]([C:6]([O:5][C:1]([CH3:4])([CH3:3])[CH3:2])=[O:7])[C:9]12[CH2:10][CH2:11][C:12]([C:17]([O:19][CH3:20])=[O:18])([CH2:15][CH2:16]1)[CH2:13][CH2:14]2)[C:24]1[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=1
参加物反応条件実験手順後処理出典と根拠反応ノート

参加物

6

反応物 3

HCID 7498Benzyl BromideHCID 24758Sodium hydrideHCID 58557079Methyl 4-((tert-butoxycarbonyl)amino)bicyclo[2.2.2]octane-1-carboxylate

生成物 1

HCID 58557870HCID 58557870、化合物収率 82.3%

試薬・触媒・溶媒 2

HCID 67553Tetrabutylammonium Iodide触媒
HCID 6228
Dimethylformamide
溶媒

反応条件

温度
0 °C

実験手順

To a solution of methyl 4-(tert-butoxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylate (2.50 g, 8.82 mmol) in DMF (42 mL) at about 0° C. was added sodium hydride (60% dispersion in mineral oil, 0.706 g, 17.6 mmol). The reaction mixture was stirred for about 30 min at about 0° C. and TBAI (0.652 g, 1.76 mmol) and benzyl bromide (2.10 mL, 17.7 mmol) were added. The reaction was warmed to ambient temperature and continued to stir for about 5 h. The solvent was removed under reduced pressure and the residue was taken up in DCM (50 mL) and water (30 mL). The layers were separated and the organic phase was washed with brine (30 mL), dried over anhydrous MgSO4, filtered and concd under reduced pressure. The resulting oil was purified by silica gel chromatography eluting with a gradient of 0-30% EtOAc in heptane to give methyl 4-(benzyl(tert-butoxycarbonyl)amino)bicyclo[2.2.2]octane-1-carboxylate (2.71 g, 82%) as a clear colorless oil: LC/MS (Table 1, Method b) Rt=3.09 min; MS m/z: 374 (M+H)+.

後処理

  1. temperatureThe reaction was warmed to ambient temperature
  2. stirringto stir for about 5 h
  3. customThe solvent was removed under reduced pressure
  4. customThe layers were separated
  5. washthe organic phase was washed with brine (30 mL)
  6. dry with materialdried over anhydrous MgSO4
  7. filtrationfiltered
  8. customThe resulting oil was purified by silica gel chromatography
  9. washeluting with a gradient of 0-30% EtOAc in heptane

出典と根拠

ORDレコード
ord-b5c58510a59249318e485c8816a3b096
出典データセット
uspto-grants-2013_04
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08426411B2

反応ノート

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