1-[Bis[5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)phenyl]-methoxymethyl]-5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)benzene | 159217-59-1

• 分子结构分类: 有机化合物
• 英文名称: 1-[Bis[5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)phenyl]-methoxymethyl]-5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)benzene
• CAS: 159217-59-1
• 化学式: C₁₀₄H₁₃₈O₄
• 分子量: 1452.24
• InChiKey: GFSBCDGTRNVBTR-UHFFFAOYSA-N

物化性质

• 密度：
  0.998±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  30
• 重原子数：
  108
• 可旋转键数：
  28
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  36.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-[Bis[5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)phenyl]-methoxymethyl]-5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)benzene 在 lithium 作用下， 以 四氢呋喃 为溶剂， 生成 1-[Bis[5-[bis(4-tert-butylphenyl)methyl]-2,4-di(propan-2-yl)phenyl]methyl]-5-[bis(4-tert-butylphenyl)methyl]-2,4-di(propan-2-yl)benzene
  参考文献：
  名称：

  Synthesis of Sterically Hindered 1,3-Connected Polyarylmethanes

  摘要：

  Sterically hindered 1,3-connected polyarylmethanes were prepared by repetitive additions of aryllithiums to carbonyl compounds. Synthetic routes with various degree of convergence were used. Variable temperature NMR spectroscopy, in conjunction with other techniques, was used to characterize the products.

  DOI：

  10.1021/jo00102a041
• 作为产物：
  描述：

  [5-(Bis-{5-[bis-(4-tert-butyl-phenyl)-methoxy-methyl]-2,4-diisopropyl-phenyl}-methoxy-methyl)-2,4-diisopropyl-phenyl]-bis-(4-tert-butyl-phenyl)-methanol 、 碘甲烷 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 以79%的产率得到1-[Bis[5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)phenyl]-methoxymethyl]-5-[bis(4-tert-butylphenyl)-methoxymethyl]-2,4-di(propan-2-yl)benzene
  参考文献：
  名称：

  Synthesis of Sterically Hindered 1,3-Connected Polyarylmethanes

  摘要：

  Sterically hindered 1,3-connected polyarylmethanes were prepared by repetitive additions of aryllithiums to carbonyl compounds. Synthetic routes with various degree of convergence were used. Variable temperature NMR spectroscopy, in conjunction with other techniques, was used to characterize the products.

  DOI：

  10.1021/jo00102a041