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Acetic Acid → Ethyl 10-(benzyl(ethyl)amino)-4-oxo-3-((phenylcarbonyl)oxy)-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate

HRID 1093084
ノート
印刷プレビュー

反応式

HRID 1093084 の反応式
Cl.[NH2:2][C:3]12[CH2:11][CH2:10][CH:7]([CH2:8][CH2:9]1)[CH2:6][N:5]1[C:12](=[O:30])[C:13]([O:21][C:22]([C:24]3[CH:29]=[CH:28][CH:27]=[CH:26][CH:25]=3)=[O:23])=[C:14]([C:16]([O:18][CH2:19][CH3:20])=[O:17])[N:15]=[C:4]21.C(N([CH2:36][CH3:37])CC)C.[CH:38](=O)[C:39]1[CH:44]=[CH:43][CH:42]=[CH:41][CH:40]=1.CC(O)=O.[BH3-]C#N.[Na+].C(=O)C>ClCCCl>[CH2:38]([N:2]([CH2:36][CH3:37])[C:3]12[CH2:11][CH2:10][CH:7]([CH2:8][CH2:9]1)[CH2:6][N:5]1[C:12](=[O:30])[C:13]([O:21][C:22]([C:24]3[CH:25]=[CH:26][CH:27]=[CH:28][CH:29]=3)=[O:23])=[C:14]([C:16]([O:18][CH2:19][CH3:20])=[O:17])[N:15]=[C:4]21)[C:39]1[CH:44]=[CH:43][CH:42]=[CH:41][CH:40]=1
参加物実験手順後処理出典と根拠反応ノート

参加物

8

反応物 6

HCID 176Acetic AcidHCID 177AcetaldehydeHCID 240BenzaldehydeHCID 8471TriethylamineHCID 5003444Sodium cyanoborohydrideHCID 66588778Ethyl 10-amino-4-oxo-3-((phenylcarbonyl)oxy)-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate hydrochloride

生成物 1

HCID 57905266
Ethyl 10-(benzyl(ethyl)amino)-4-oxo-3-((phenylcarbonyl)oxy)-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate

試薬・触媒・溶媒 1

HCID 111,2-Dichloroethane溶媒

実験手順

To a stirred solution of Ethyl 10-amino-4-oxo-3-((phenylcarbonyl)oxy)-4,6,7,8,9,10-hexahydro-7,10-ethanopyrimido[1,2-a]azepine-2-carboxylate hydrochloride (200 mg, 0.461 mmol) in 1,2-dichloroethane (10 mL) was added triethylamine (0.064 mL, 0.461 mmol) and the resulting mixture stirred for 5 min. Benzaldehyde (0.186 mL, 1.844 mmol), AcOH (0.053 mL, 0.922 mmol) and NaCNBH3 (87 mg, 1.383 mmol) were then added and the mixture stirred for 6 h. Acetaldehyde (0.182 mL, 3.23 mmol) was then added to the reaction and the this was stirred at room temperature for 16 h. The mixture was then quenched with sat. NaHCO3 and extracted with dichloromethane, dried (Na2SO4), filtered and concentrated to afford title compound.

後処理

  1. stirringthe mixture stirred for 6 h
  2. stirringthe this was stirred at room temperature for 16 h
  3. customThe mixture was then quenched with sat. NaHCO3
  4. extractionextracted with dichloromethane
  5. dry with materialdried (Na2SO4)
  6. filtrationfiltered
  7. concentrationconcentrated

出典と根拠

ORDレコード
ord-cb8c9b20c93e408c93601cdf83478456
出典データセット
uspto-grants-2012_03
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US08129398B2

反応ノート

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