1,1'-(((((((1,3-dioxane-5,5-diyl)bis(methylene))bis(oxy))bis(methylene))bis(1,3-dioxane-5,5-diyl))bis(methylene))bis(oxy))bis(N,N,N',N'-tetraethylphosphanediamine) | 1186366-71-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氧戊环
• 英文名称: 1,1'-(((((((1,3-dioxane-5,5-diyl)bis(methylene))bis(oxy))bis(methylene))bis(1,3-dioxane-5,5-diyl))bis(methylene))bis(oxy))bis(N,N,N',N'-tetraethylphosphanediamine)
• CAS: 1186366-71-1
• 化学式: C₃₄H₇₀N₄O₁₀P₂
• 分子量: 756.898
• InChiKey: FBDVTPRZCAUHOZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.85
• 重原子数：
  50.0
• 可旋转键数：
  26.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  105.26
• 氢给体数：
  0.0
• 氢受体数：
  14.0

反应信息

• 作为反应物：
  描述：

  1,1'-(((((((1,3-dioxane-5,5-diyl)bis(methylene))bis(oxy))bis(methylene))bis(1,3-dioxane-5,5-diyl))bis(methylene))bis(oxy))bis(N,N,N',N'-tetraethylphosphanediamine) 在 sulfur 作用下， 反应 4.0h， 以0.4 g的产率得到1,11-di(diethylthionophosphate)-2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecanediol
  参考文献：
  名称：

  Pioneering examples of preparative phosphorylation of pentaerythritol

  摘要：

  The transacetalization of dimethoxyethane with tripcntaerythritol affords respective trimethylene diol. The oligools derived from the tripentaerytritol and its trimethylene derivative were used in the syntheses of unusual oligophosphites that might be interesting as ligands for intricate metal complex constructions.

  DOI：

  10.1134/s1070363208080070
• 作为产物：
  描述：

  Tripentaerythrit-triformal 、 六乙基亚磷酸胺 以 1,4-二氧六环 为溶剂， 反应 50.0h， 生成 1,1'-(((((((1,3-dioxane-5,5-diyl)bis(methylene))bis(oxy))bis(methylene))bis(1,3-dioxane-5,5-diyl))bis(methylene))bis(oxy))bis(N,N,N',N'-tetraethylphosphanediamine)
  参考文献：
  名称：

  Pioneering examples of preparative phosphorylation of pentaerythritol

  摘要：

  The transacetalization of dimethoxyethane with tripcntaerythritol affords respective trimethylene diol. The oligools derived from the tripentaerytritol and its trimethylene derivative were used in the syntheses of unusual oligophosphites that might be interesting as ligands for intricate metal complex constructions.

  DOI：

  10.1134/s1070363208080070