3-[[6-[2-(2-Hydroxypropan-2-yl)octyl]pyridin-2-yl]methyl]-2-methylnonan-2-ol | 1105679-85-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 3-[[6-[2-(2-Hydroxypropan-2-yl)octyl]pyridin-2-yl]methyl]-2-methylnonan-2-ol
• CAS: 1105679-85-3
• 化学式: C₂₇H₄₉NO₂
• 分子量: 419.692
• InChiKey: AEIGOPQGIQYJJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  30
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  53.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2,6-二甲基吡啶 、 2-methyl-2,3-epoxynonane 在 lithium diisopropyl amide 作用下， 以 四氢呋喃 为溶剂， 以12%的产率得到2-methyl-3-((6-methylpyridin-2-yl)methyl)nonan-2-ol
  参考文献：
  名称：

  Alkylation of 2-Substituted (6-Methyl-2-pyridyl)methyllithium Species with Epoxides

  摘要：

  Substituted (6-methyl-2-pyridyl)methyllithium species were reacted with 1,2-epoxyoctane and 2-methyl-2,3-epoxynonane. The monosubstituted epoxide reacted efficiently with lutidyllithium and a number of 2-substituted (6-methyl-2-pyridyl)methyllithium derivatives. The trisubstituted epoxide gave low yields of adducts with all (2-pyridyl)methyllithium species studied. These results are discussed in the context of a proposed synthesis of cananodine.

  DOI：

  10.1021/jo802267n

文献信息

• Alkylation of 2-Substituted (6-Methyl-2-pyridyl)methyllithium Species with Epoxides
  作者：James R. Vyvyan、Rebecca C. Brown、Brian P. Woods

  DOI：10.1021/jo802267n

  日期：2009.2.6

  Substituted (6-methyl-2-pyridyl)methyllithium species were reacted with 1,2-epoxyoctane and 2-methyl-2,3-epoxynonane. The monosubstituted epoxide reacted efficiently with lutidyllithium and a number of 2-substituted (6-methyl-2-pyridyl)methyllithium derivatives. The trisubstituted epoxide gave low yields of adducts with all (2-pyridyl)methyllithium species studied. These results are discussed in the context of a proposed synthesis of cananodine.