N3,N3,N9,N9,N15,N15,N21,N21-octamethyl-6,12,18,39-tetra(dimethylaminomethyl)-25,29,33,37-tetraethyl-2,4,8,10,14,16,20,22-tetraoxa-3,9,15,21-tetraphosphanonacyclo[21,15.1.1^24,38.0^5,36.0^7,32.0^13,30.0^17,28.0^19,26.]tetraconta-1(38),5,7(34)... | 206115-86-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N3,N3,N9,N9,N15,N15,N21,N21-octamethyl-6,12,18,39-tetra(dimethylaminomethyl)-25,29,33,37-tetraethyl-2,4,8,10,14,16,20,22-tetraoxa-3,9,15,21-tetraphosphanonacyclo[21,15.1.1^24,38.0^5,36.0^7,32.0^13,30.0^17,28.0^19,26.]tetraconta-1(38),5,7(34)...
• 英文别名: 5,11,17,23-tetrakis(dimethylaminomethyl)-2,8,14,20-tetraethylpentacyclo[19.3.1.1^3,7.1^9,13.1^15,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-6,10,12,16,18,22,24,4-tetra(dimethylphosphoramidite)；6,12,18,39-tetrakis[(dimethylamino)methyl]-25,29,33,37-tetraethyl-3-N,3-N,9-N,9-N,15-N,15-N,21-N,21-N-octamethyl-2,4,8,10,14,16,20,22-octaoxa-3,9,15,21-tetraphosphanonacyclo[21.15.1.124,38.05,36.07,34.011,32.013,30.017,28.019,26]tetraconta-1(39),5,7(34),11,13(30),17(28),18,23,26,31,35,38(40)-dodecaene-3,9,15,21-tetramine
• CAS: 206115-86-8
• 化学式: C₅₆H₈₄N₈O₈P₄
• 分子量: 1121.23
• InChiKey: QYVNFOVLYDSURW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  76
• 可旋转键数：
  16
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  99.8
• 氢给体数：
  0
• 氢受体数：
  16

反应信息

• 作为反应物：
  描述：

  N3,N3,N9,N9,N15,N15,N21,N21-octamethyl-6,12,18,39-tetra(dimethylaminomethyl)-25,29,33,37-tetraethyl-2,4,8,10,14,16,20,22-tetraoxa-3,9,15,21-tetraphosphanonacyclo[21,15.1.1^24,38.0^5,36.0^7,32.0^13,30.0^17,28.0^19,26.]tetraconta-1(38),5,7(34)... 在 水 作用下， 以 乙醚 为溶剂， 反应 12.0h， 以100%的产率得到[5,11,17,23-tetra(dimethylaminomethyl)-2,8,14,20-tetraethyl-4,10,16,22-tetrahydroxypentacyclo[19.3.1.1^3,7.1^9,13.1^15,19]octacosa-1⁽²⁴⁾,3,5,7⁽²⁸⁾,9,11,13⁽²⁷⁾,15⁽²⁶⁾,16,18,21⁽²⁵⁾,22-dodecaen-6,12,18,24-tetrayl] tetrakis(dimethylphosphonamidate)
  参考文献：
  名称：

  摘要：

  A series of aminophosphino cavitands were synthesized by reactions of dialkylaminomethyl-substituted calix[4]resorcinolarenes with hexaalkylphosphorous triamides, and their properties were studied. New aminoalkylated (thio)phosphato(phosphonato) cavitands were prepared by phosphorylation of dialkylaminomethyl-substituted calix[4]resorcinolarenes with phosphorus(V) dichlorides in the presence of a base. Their reactions with electrophilic alkylating agents (methyl trifluoromethanesulfonate, methyl iodide, and triethyloxonium tetrafluoroborate) were examined.

  DOI：

  10.1023/a:1026300817910
• 作为产物：
  描述：

  [5,11,17,23-tetra(dimethylaminomethyl)-2,8,14,20-tetraethyl-4,10,16,22-tetrahydroxypentacyclo[19.3.1.1^3,7.1^9,13.1^15,19]octacosa-1⁽²⁴⁾,3,5,7⁽²⁸⁾,9,11,13⁽²⁷⁾,15⁽²⁶⁾,16,18,21⁽²⁵⁾,22-dodecaen-6,12,18,24-tetrayl] tetrakis(dimethylphosphonamidate) 以 苯 为溶剂， 反应 2.0h， 生成 N3,N3,N9,N9,N15,N15,N21,N21-octamethyl-6,12,18,39-tetra(dimethylaminomethyl)-25,29,33,37-tetraethyl-2,4,8,10,14,16,20,22-tetraoxa-3,9,15,21-tetraphosphanonacyclo[21,15.1.1^24,38.0^5,36.0^7,32.0^13,30.0^17,28.0^19,26.]tetraconta-1(38),5,7(34)...
  参考文献：
  名称：

  Burilov; Makeeva; Bashmakova, Russian Journal of General Chemistry, 1999, vol. 69, # 3, p. 491 - 492

  摘要：

  DOI：

文献信息

• Burilov, A. R.; Nikolaeva, I. L.; Makeeva, T. V., Russian Journal of General Chemistry, 1997, vol. 67, # 5, p. 821 - 822
  作者：Burilov, A. R.、Nikolaeva, I. L.、Makeeva, T. V.、Pudovik, M. A.、Reznik, V. S.、ert al.

  DOI：——

  日期：——
• ——
  作者：A. R. Burilov、D. I. Kharitonov、N. I. Bashmakova、T. B. Makeeva、I. L. Nikolaeva、M. A. Pudovik、A. I. Konovalov

  DOI：10.1023/a:1026300817910

  日期：——

  A series of aminophosphino cavitands were synthesized by reactions of dialkylaminomethyl-substituted calix[4]resorcinolarenes with hexaalkylphosphorous triamides, and their properties were studied. New aminoalkylated (thio)phosphato(phosphonato) cavitands were prepared by phosphorylation of dialkylaminomethyl-substituted calix[4]resorcinolarenes with phosphorus(V) dichlorides in the presence of a base. Their reactions with electrophilic alkylating agents (methyl trifluoromethanesulfonate, methyl iodide, and triethyloxonium tetrafluoroborate) were examined.
• Burilov; Makeeva; Bashmakova, Russian Journal of General Chemistry, 1999, vol. 69, # 3, p. 491 - 492
  作者：Burilov、Makeeva、Bashmakova、Kharitonov、Nikolaeva、Pudovik、Reznik、Konovalova

  DOI：——

  日期：——