Ethyl 6-[6-[[6-[6-[[6-(6-ethoxycarbonylpyridin-2-yl)pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridine-2-carboxylate | 871842-57-8

• 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: Ethyl 6-[6-[[6-[6-[[6-(6-ethoxycarbonylpyridin-2-yl)pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridine-2-carboxylate
• CAS: 871842-57-8
• 化学式: C₄₈H₃₈N₆O₆P₂
• 分子量: 856.814
• InChiKey: ZVGMHRJVANRUJV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.3
• 重原子数：
  62
• 可旋转键数：
  15
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  164
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  Ethyl 6-[6-[[6-[6-[[6-(6-ethoxycarbonylpyridin-2-yl)pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridine-2-carboxylate 在 盐酸 作用下， 以 水 为溶剂， 反应 20.0h， 以83%的产率得到
  参考文献：
  名称：

  Bridging of Bipyridine Units by Phenylphosphine Links:  Linear and Cyclic Oligomers and Some Acid Derivatives

  摘要：

  Reaction of 6,6'-dibromo-2,2'-bipyridine with phenylphosphine under palladium-promoted cross-coupling conditions provides a variety of linear oligomers bearing two reactive bromo substituents as well as a cyclic dimer, characterized by X-ray crystallography, in which the bipyridine units are constrained to a cis configuration by two phenylphosphine oxide bridges. Derivatives of the linear species containing both carboxylate and phosphonate substituents are readily obtained.

  DOI：

  10.1021/jo051586g
• 作为产物：
  描述：

  6,6'-二溴-2,2'-联吡啶 在 bis-triphenylphosphine-palladium(II) chloride 、 四(三苯基膦)钯 、 di(isopropyl)thylamine 、 三乙胺 作用下， 以 乙腈 为溶剂， 反应 39.0h， 生成 Ethyl 6-[6-[[6-[6-[[6-(6-ethoxycarbonylpyridin-2-yl)pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridin-2-yl]-phenylphosphoryl]pyridin-2-yl]pyridine-2-carboxylate
  参考文献：
  名称：

  Bridging of Bipyridine Units by Phenylphosphine Links:  Linear and Cyclic Oligomers and Some Acid Derivatives

  摘要：

  Reaction of 6,6'-dibromo-2,2'-bipyridine with phenylphosphine under palladium-promoted cross-coupling conditions provides a variety of linear oligomers bearing two reactive bromo substituents as well as a cyclic dimer, characterized by X-ray crystallography, in which the bipyridine units are constrained to a cis configuration by two phenylphosphine oxide bridges. Derivatives of the linear species containing both carboxylate and phosphonate substituents are readily obtained.

  DOI：

  10.1021/jo051586g

文献信息

• Bridging of Bipyridine Units by Phenylphosphine Links:  Linear and Cyclic Oligomers and Some Acid Derivatives
  作者：Raymond F. Ziessel、Loïc J. Charbonnière、Samir Mameri、Franck Camerel

  DOI：10.1021/jo051586g

  日期：2005.11.1

  Reaction of 6,6'-dibromo-2,2'-bipyridine with phenylphosphine under palladium-promoted cross-coupling conditions provides a variety of linear oligomers bearing two reactive bromo substituents as well as a cyclic dimer, characterized by X-ray crystallography, in which the bipyridine units are constrained to a cis configuration by two phenylphosphine oxide bridges. Derivatives of the linear species containing both carboxylate and phosphonate substituents are readily obtained.