2-[2,2-Bis[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium-2-yl)oxymethyl]butoxy]-5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium | 83044-95-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氧杂环化合物
• 英文名称: 2-[2,2-Bis[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium-2-yl)oxymethyl]butoxy]-5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium
• 英文别名: 2-[2,2-bis[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium-2-yl)oxymethyl]butoxy]-5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium
• CAS: 83044-95-5
• 化学式: C₂₁H₄₁O₁₂P₃
• 分子量: 578.471
• InChiKey: QYDAJCIIJOKLAO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  36
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  152
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  2,2'-((2-(((5,5-dimethyl-1,3,2-dioxaphosphinan-2-yl)oxy)methyl)-2-ethylpropane-1,3-diyl)bis(oxy))bis(5,5-dimethyl-1,3,2-dioxaphosphinane) 在 过氧化脲素 作用下， 以 四氯化碳 为溶剂， 反应 4.0h， 以75%的产率得到2-[2,2-Bis[(5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium-2-yl)oxymethyl]butoxy]-5,5-dimethyl-2-oxido-1,3,2-dioxaphosphinan-2-ium
  参考文献：
  名称：

  Tris-phosphorylated esters of symmetrical and unsymmetrical triols

  摘要：

  By reaction of a series of triols and monosaccharides with 5,5-dimethyl-2-chloro-1,3,2-dioxaphosphorinane their tris-phosphorylated derivatives were synthesized, and the simplest chemical transformations of the latter were studied. Structures of the obtained P(V) derivatives were confirmed by (1)H, (13)C and (31)P NMR spectroscopy and by the MALDI TOF mass spectrometry and X-ray structural analysis.

  DOI：

  10.1134/s1070363208050083

文献信息

• Tris-phosphorylated esters of symmetrical and unsymmetrical triols
  作者：N. M. Pugashova、A. M. Koroteev、I. S. Bushmarinov、K. A. Lysenko、E. N. Andriutse、M. P. Koroteev、E. E. Nifant’ev

  DOI：10.1134/s1070363208050083

  日期：2008.5

  By reaction of a series of triols and monosaccharides with 5,5-dimethyl-2-chloro-1,3,2-dioxaphosphorinane their tris-phosphorylated derivatives were synthesized, and the simplest chemical transformations of the latter were studied. Structures of the obtained P(V) derivatives were confirmed by (1)H, (13)C and (31)P NMR spectroscopy and by the MALDI TOF mass spectrometry and X-ray structural analysis.