(S)-2-phenyl-6,7-dihydro-5H-<1>pyridin-7-yl-(-)-menthyl carbonate N-oxide | 247185-51-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: (S)-2-phenyl-6,7-dihydro-5H-<1>pyridin-7-yl-(-)-menthyl carbonate N-oxide
• 英文别名: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] [(7S)-1-oxido-2-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-7-yl] carbonate
• CAS: 247185-51-9
• 化学式: C₂₅H₃₁NO₄
• 分子量: 409.525
• InChiKey: FFOLANVWGABWKX-XEDHWARRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.59
• 重原子数：
  30.0
• 可旋转键数：
  4.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  62.47
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  (S)-2-phenyl-6,7-dihydro-5H-<1>pyridin-7-yl-(-)-menthyl carbonate N-oxide 在 氢氧化钾 、 三氯化磷 作用下， 以 甲醇 、 氯仿 为溶剂， 反应 4.0h， 生成 (S)-7-hydroxy-2-phenyl-6,7-dihydro-5H-[1]pyrindine
  参考文献：
  名称：

  Synthesis of chiral plane-extended pyridyl alcohols for the enantioselective addition of diethylzinc to aldehydes

  摘要：

  Enantiomerically pure pyridyl alcohols, 1 and 2, were prepared from readily available racemic pyridyl alcohol 3 and applied to the enantioselective addition of diethylzinc to aldehydes resulting in moderately high enantiomeric excess (90%) in the case of benzaldehyde. In this study the first example of an alteration in the configuration of the product upon change of a non-chiral and non-coordinating part of the catalyst was observed. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(99)00247-5
• 作为产物：
  描述：

  1'-Hydroxy-6-phenyl-2,3-pyrido-Δ^4'-cyclopenten 在 正丁基锂 、 间氯过氧苯甲酸 作用下， 以 氯仿 为溶剂， 反应 74.0h， 生成 (S)-2-phenyl-6,7-dihydro-5H-<1>pyridin-7-yl-(-)-menthyl carbonate N-oxide
  参考文献：
  名称：

  Synthesis of chiral plane-extended pyridyl alcohols for the enantioselective addition of diethylzinc to aldehydes

  摘要：

  Enantiomerically pure pyridyl alcohols, 1 and 2, were prepared from readily available racemic pyridyl alcohol 3 and applied to the enantioselective addition of diethylzinc to aldehydes resulting in moderately high enantiomeric excess (90%) in the case of benzaldehyde. In this study the first example of an alteration in the configuration of the product upon change of a non-chiral and non-coordinating part of the catalyst was observed. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0957-4166(99)00247-5