Tert-butyl 4-(2-(methoxycarbonyl)propyl)-4-nitropiperidine-1-carboxylate | 1234481-63-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: Tert-butyl 4-(2-(methoxycarbonyl)propyl)-4-nitropiperidine-1-carboxylate
• 英文别名: tert-butyl 4-(3-methoxy-2-methyl-3-oxopropyl)-4-nitropiperidine-1-carboxylate
• CAS: 1234481-63-0
• 化学式: C₁₅H₂₆N₂O₆
• 分子量: 330.381
• InChiKey: GLHNPQLUHQLSQT-UHFFFAOYSA-N

物化性质

• 沸点：
  414.4±38.0 °C(Predicted)
• 密度：
  1.16±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  102
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  Tert-butyl 4-(2-(methoxycarbonyl)propyl)-4-nitropiperidine-1-carboxylate 在 氢气 作用下， 反应 12.0h， 生成 tert-butyl 3-methyl-2-oxo-1,8-diazaspiro[4.5]decane-8-carboxylate
  参考文献：
  名称：

  N-Boc 4-nitropiperidine: preparation and conversion into a spiropiperidine analogue of the eastern part of maraviroc

  摘要：

  Previously unreported N-Boc 4-nitropiperidine was prepared in two steps from N-Boc-piperidone. The synthetic utility of this new intermediate was demonstrated by the development of a new and simple route to spirolactam piperidines. Further synthetic work involving a challenging triazole cyclisation allowed the preparation of a spiropiperidine analogue of the eastern part of maraviroc. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.04.046
• 作为产物：
  描述：

  叔丁基 4-硝基哌啶-1-羧酸 、 甲基丙烯酸甲酯 在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 反应 15.0h， 生成 Tert-butyl 4-(2-(methoxycarbonyl)propyl)-4-nitropiperidine-1-carboxylate
  参考文献：
  名称：

  N-Boc 4-nitropiperidine: preparation and conversion into a spiropiperidine analogue of the eastern part of maraviroc

  摘要：

  Previously unreported N-Boc 4-nitropiperidine was prepared in two steps from N-Boc-piperidone. The synthetic utility of this new intermediate was demonstrated by the development of a new and simple route to spirolactam piperidines. Further synthetic work involving a challenging triazole cyclisation allowed the preparation of a spiropiperidine analogue of the eastern part of maraviroc. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.04.046

文献信息

• N-Boc 4-nitropiperidine: preparation and conversion into a spiropiperidine analogue of the eastern part of maraviroc
  作者：Philip Mullen、Hugues Miel、M. Anthony McKervey

  DOI：10.1016/j.tetlet.2010.04.046

  日期：2010.6

  Previously unreported N-Boc 4-nitropiperidine was prepared in two steps from N-Boc-piperidone. The synthetic utility of this new intermediate was demonstrated by the development of a new and simple route to spirolactam piperidines. Further synthetic work involving a challenging triazole cyclisation allowed the preparation of a spiropiperidine analogue of the eastern part of maraviroc. (C) 2010 Elsevier Ltd. All rights reserved.