18,37-dimethyl-3,6,9,12,15,19,23,26,29,32,36-undecaoxa-2,16-dioxo-20,20,35,35-tetraphenyltricyclo[32.3.0.0(17,21)]heptatriaconta-17,37-diene | 1224127-80-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 18,37-dimethyl-3,6,9,12,15,19,23,26,29,32,36-undecaoxa-2,16-dioxo-20,20,35,35-tetraphenyltricyclo[32.3.0.0(17,21)]heptatriaconta-17,37-diene
• CAS: 1224127-80-3
• 化学式: C₅₂H₆₀O₁₃
• 分子量: 893.041
• InChiKey: QPCSDRCFAIRVIS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.93
• 重原子数：
  65.0
• 可旋转键数：
  4.0
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  135.67
• 氢给体数：
  0.0
• 氢受体数：
  13.0

反应信息

• 作为产物：
  描述：

  4,7,10,13-tetraoxa-1,1,16,16-tetraphenyl-1,15-hexadecadiene 、 tetraethylene glycol bis(acetoacetate) 在 manganese(III) triacetate dihydrate 、 溶剂黄146 作用下， 反应 0.5h， 以39%的产率得到18,37-dimethyl-3,6,9,12,15,19,23,26,29,32,36-undecaoxa-2,16-dioxo-20,20,35,35-tetraphenyltricyclo[32.3.0.0(17,21)]heptatriaconta-17,37-diene
  参考文献：
  名称：

  Efficient macrocyclization using methylene-tethered terminal dienes and bis(manganese(III)-enolate)s

  摘要：

  Macrocyclic compounds, which have two fused dihydrofuran rings, were synthesized with complete control by the oxidation of alpha,alpha,omega,omega-tetraaryl-alpha(omega-1)-alkadienes 1(x) with manganese(III)-oligomethylenebis(enolate) complexes directly formed by the reaction of the ohgomethylene bis(3-oxobutanoate)s 2(y) with manganese(III) acetate in situ The oxamethylene-tethered macrodiolides 5 and 7 were also produced in good to moderate yields by a similar oxidation The key intermediate, an election donor-acceptor-like complex, was proposed for the efficient macrocyclization reaction (C) 2010 Elsevier Ltd. All rights reserved

  DOI：

  10.1016/j.tet.2010.02.022