| 189440-65-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• CAS: 189440-65-1
• 化学式: C₃₃H₂₂O₅
• 分子量: 498.535
• InChiKey: SBZBPXHATHVCJQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  38
• 可旋转键数：
  1
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  在 硫酸 作用下， 以 丙醇 、 水 为溶剂， 反应 96.0h， 以95%的产率得到5-(7-Oxo-7H-benzo[de]anthracen-3-yl)-acenaphthylene-1,2-dione
  参考文献：
  名称：

  Benzoylperylenedicarboximides: Functional dyes with attractive optical and electronic properties

  摘要：

  Little is known about benzoylperleneimides 3. Two new syntheses of 3 have been worked out. based on boronic acid and organotin intermediates. respectively. These mild methods allow the isolation of the uncyclized precursor 10 and the introduction of various groups R. The purple benzoylperyleneimides 3 are fluorescent dyes and exhibit a high thermal and photochemical stability. The electrochemical properties have been investigated showing that 3 can take up 2 electrons while 10 accepts 4 electrons due to the existence of two weakly interacting anyl units. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(97)00381-5
• 作为产物：
  描述：

  3-溴苯并蒽酮 、 5'-bromodispiro[[1,3]dioxolane-2,1'-acenaphthylene-2',2''-[1,3]dioxolane] 在 四(三苯基膦)钯 、 正丁基锂 、 硼酸三异丙酯 、 potassium carbonate 作用下， 生成
  参考文献：
  名称：

  Benzoylperylenedicarboximides: Functional dyes with attractive optical and electronic properties

  摘要：

  Little is known about benzoylperleneimides 3. Two new syntheses of 3 have been worked out. based on boronic acid and organotin intermediates. respectively. These mild methods allow the isolation of the uncyclized precursor 10 and the introduction of various groups R. The purple benzoylperyleneimides 3 are fluorescent dyes and exhibit a high thermal and photochemical stability. The electrochemical properties have been investigated showing that 3 can take up 2 electrons while 10 accepts 4 electrons due to the existence of two weakly interacting anyl units. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4020(97)00381-5

文献信息

• Benzoylperylenedicarboximides: Functional dyes with attractive optical and electronic properties
  作者：Frank O. Holtrup、Gert R.J. Müller、Jochen Uebe、Klaus Müllen

  DOI：10.1016/s0040-4020(97)00381-5

  日期：1997.5

  Little is known about benzoylperleneimides 3. Two new syntheses of 3 have been worked out. based on boronic acid and organotin intermediates. respectively. These mild methods allow the isolation of the uncyclized precursor 10 and the introduction of various groups R. The purple benzoylperyleneimides 3 are fluorescent dyes and exhibit a high thermal and photochemical stability. The electrochemical properties have been investigated showing that 3 can take up 2 electrons while 10 accepts 4 electrons due to the existence of two weakly interacting anyl units. (C) 1997 Elsevier Science Ltd.