| 1416431-62-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1416431-62-3
• 化学式: C₈₁H₁₁₉NOSi₂
• 分子量: 1179.01
• InChiKey: USKSXFOODWXBHT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  22.65
• 重原子数：
  85.0
• 可旋转键数：
  35.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  29.1
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Topochemical Polymerization of Phenylacetylene Macrocycles: A New Strategy for the Preparation of Organic Nanorods

  摘要：

  Soluble organic nanorods were prepared from phenylacetylene macrocycles using the topochemical polymerization of butadiyne moieties placed both inside and outside the macrocycles' skeletons. Macrocycles containing amide groups were self-assembled in a columnar fashion through the formation of an organogel in ethyl acetate. Upon irradiation with UV light, the Raman signals associated with butadiyne units completely vanished, indicating the creation of covalently linked nanorods.

  DOI：

  10.1021/ja3116422
• 作为产物：
  描述：

  icosa-5,7-diynyltosylate 在 4-二甲氨基吡啶 、 bis-triphenylphosphine-palladium(II) chloride 、 copper(l) iodide 、 sodium azide 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 三乙胺 、 N,N-二异丙基乙胺 、 tin(ll) chloride 、 potassium hydroxide 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 7.0h， 生成
  参考文献：
  名称：

  Topochemical Polymerization of Phenylacetylene Macrocycles: A New Strategy for the Preparation of Organic Nanorods

  摘要：

  Soluble organic nanorods were prepared from phenylacetylene macrocycles using the topochemical polymerization of butadiyne moieties placed both inside and outside the macrocycles' skeletons. Macrocycles containing amide groups were self-assembled in a columnar fashion through the formation of an organogel in ethyl acetate. Upon irradiation with UV light, the Raman signals associated with butadiyne units completely vanished, indicating the creation of covalently linked nanorods.

  DOI：

  10.1021/ja3116422