N18,N18,N38,N38-tetraethyl-3,13,24,33-tetraphenyl-2,4,8,12,14,17,19,23,25,28,32,34,37,39-tetradecaoxa-18,38-diphosphatetraspiro[5.3.510.5.521.3.530.56]tetracontane-18,38-diamine | 929038-92-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二恶烷
• 英文名称: N18,N18,N38,N38-tetraethyl-3,13,24,33-tetraphenyl-2,4,8,12,14,17,19,23,25,28,32,34,37,39-tetradecaoxa-18,38-diphosphatetraspiro[5.3.510.5.521.3.530.56]tetracontane-18,38-diamine
• CAS: 929038-92-6
• 化学式: C₅₆H₇₆N₂O₁₄P₂
• 分子量: 1063.17
• InChiKey: VLTKXUUDZMABCL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.16
• 重原子数：
  74.0
• 可旋转键数：
  10.0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  135.7
• 氢给体数：
  0.0
• 氢受体数：
  16.0

反应信息

• 作为反应物：
  描述：

  N18,N18,N38,N38-tetraethyl-3,13,24,33-tetraphenyl-2,4,8,12,14,17,19,23,25,28,32,34,37,39-tetradecaoxa-18,38-diphosphatetraspiro[5.3.510.5.521.3.530.56]tetracontane-18,38-diamine 在 sulfur 作用下， 以 1,4-二氧六环 为溶剂， 反应 1.0h， 以0.48 g的产率得到
  参考文献：
  名称：

  New phosphorus-containing macroheterocyclic cavitands

  摘要：

  Previously unknown phosphorus-containing macroheterocycles were prepared from an accessible symmetrical dipentaerythritol derivative and trivalent phosphorus compounds. The difference in the properties of the phosphocycles containing one and two phosphoric functions was revealed.

  DOI：

  10.1134/s1070363206080056
• 作为产物：
  描述：

  2',2'':6',6''-di-O-benzylidene-2',2'',6',6''-tetra-(hydroxymethyl)-4-oxa-1,7-heptanediol 以 1,4-二氧六环 为溶剂， 反应 62.0h， 生成 N18,N18,N38,N38-tetraethyl-3,13,24,33-tetraphenyl-2,4,8,12,14,17,19,23,25,28,32,34,37,39-tetradecaoxa-18,38-diphosphatetraspiro[5.3.510.5.521.3.530.56]tetracontane-18,38-diamine
  参考文献：
  名称：

  New phosphorus-containing macroheterocyclic cavitands

  摘要：

  Previously unknown phosphorus-containing macroheterocycles were prepared from an accessible symmetrical dipentaerythritol derivative and trivalent phosphorus compounds. The difference in the properties of the phosphocycles containing one and two phosphoric functions was revealed.

  DOI：

  10.1134/s1070363206080056