暂无可渲染的结构数据
C1CC2C(=O)NCC1N2CC3=CC=CC=C3中间体产品
8-benzyl-3,8-diazabicyclo[3.2.1]octan-2-one
结构、标识符和计算性质已按 CAS 与数据库记录完成匹配。
| 中文名称 | 8-苄基-3,8-二氮杂双环[3.2.1]辛烷-2-酮 |
|---|---|
| English name | 8-benzyl-3,8-diazabicyclo[3.2.1]octan-2-one |
| IUPAC 名称 | — |
| CAS号 | 824982-17-4 |
| 数据库编号 | 21904723 |
| 分子式 | — |
| 分子量 | — |
产品信息
8-苄基-3,8-二氮杂双环[3.2.1]辛烷-2-酮（CAS 824982-17-4）的产品身份、结构标识及相关反应资料，供化学中间体检索、研发和采购评估使用。
可能的应用方向
仅供专业研发与工业用途
数据库编号 21904723
安全提示
仅供专业研发与工业用途。操作前请依据供应商提供的安全数据表完成风险评估。
合成路线数据
12 条反应 · 12 篇文献
反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-2e950d53b7c74bea81083b15680e0703反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-5e3812a945a54bb3a63331c3b8ade47e反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-5e3812a945a54bb3a63331c3b8ade47e反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-88cbf3f97e11468b9a6481d374e33262反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-5e3812a945a54bb3a63331c3b8ade47e反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-2e950d53b7c74bea81083b15680e0703反应条件: temp:60.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: 8-Benzyl-3,8-diazabicyclo[3.2.1]octan-2-one (5.87 g, 27.1 mmol) in dry tetrahydrofuran (40 mL) was treated with 1M lithium aluminum hydride in THF (81.4 mL), heated at 60° C. for 2 hours, and then allowed to cool to room temperature and stir overnight. The mixture was cooled to 0° C. and treated in succession with water (4.4 mL), tetrahydrofuran (200 mL), 15% sodium hydroxide solution (4.4 mL), and water (13.3 mL). The mixture was filtered and the filter cake was rinsed with ethyl acetate. The filtrate was concentrated under reduced pressure to provide the title compound. MS (DCI/NH3) m/z: 203 (M+H)+. to cool to room temperature The mixture was cooled to 0° C. The mixture was filtered the filter cake was rinsed with ethyl acetate The filtrate was concentrated under reduced pressure
来源 ID: ord-6541db5665204de687e2c82f11ea6370反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: Methyl 1-benzyl-5-(nitromethylene)-2-pyrrolidinecarboxylate (9.92 g, 35.9 mmol) and 5% platinum on activated carbon (11.25 g) were combined in methanol (100 mL) and shaken for 56 hours at ambient temperature under a hydrogen atmosphere (60 psi). The moisture was filtered and the filtrate concentrated to provide the title compound. MS (DCI/NH3) m/z: 217 (M+H)+. The moisture was filtered the filtrate concentrated
来源 ID: ord-61a470e5686246deb3f2b9c4ce994736反应条件: temp:60.01; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: 8-Benzyl-3,8-diazabicyclo[3.2.1]octan-2-one (5.87 g, 27.1 mmol) in dry tetrahydrofuran (40 mL) was treated with 1M lithium aluminum hydride in THF (81.4 mL), heated at 60° C. for 2 hours, and then allowed to cool to room temperature and stir overnight. The mixture was cooled to 0° C. and treated in succession with water (4.4 mL), tetrahydrofuran (200 mL), 15% sodium hydroxide solution (4.4 mL), and water (13.3 mL). The mixture was filtered and the filter cake was rinsed with ethyl acetate. The filtrate was concentrated under reduced pressure to provide the title compound. MS (DCI/NH3) m/z: 203 (M+H)+. to cool to room temperature The mixture was cooled to 0° C. The mixture was filtered the filter cake was rinsed with ethyl acetate The filtrate was concentrated under reduced pressure
来源 ID: ord-99769cc996174cbba9cee30a1da6e8ce反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: Methyl 1-benzyl-5-(nitromethylene)-2-pyrrolidinecarboxylate (9.92 g, 35.9 mmol) and 5% platinum on activated carbon (11.25 g) were combined in methanol (100 mL) and shaken for 56 hours at ambient temperature under a hydrogen atmosphere (60 psi). The misture was filtered and the filtrate concentrated to provide the title compound. MS (DCI/NH3) m/z: 217 (M+H)+. The misture was filtered the filtrate concentrated
来源 ID: ord-b08555579183468dabae223e51a9e25f反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-88cbf3f97e11468b9a6481d374e33262反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The product of Example 1E (2.88 g, 13.3 mmol) in 40 mL THF was added via cannula to a mixture of LiAlH4 (1.52 g, 39.9 mmol) in 40 mL THF at 0° C. After the addition was complete, the reaction mixture was allowed to warm to ambient temperature and stir for 2 h. The mixture was warmed to reflux and stirred for 1 h. The reaction was cooled to 0° C. then 1.5 mL H2O, 1.5 mL 15% NaOH and 4.5 mL H2O were added sequentially to quench the reaction. The material was filtered, the residue was washed with EtOAc, and the filtrate was concentrated under reduced pressure and carried on directly to the next reaction. MS (DCl/NH3) m/z 203 (M+H)+. After the addition The mixture was warmed to reflux stirred for 1 h The reaction was cooled to 0° C. to quench the reaction The material was filtered the residue was washed with EtOAc the filtrate was concentrated under reduced pressure directly to the next reaction
来源 ID: ord-5e3812a945a54bb3a63331c3b8ade47ePubChem References
以下资料来自该化合物的公开数据库参考记录。
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