13,27-Ditert-butyl-5,19-diphenyl-9,23-dioxaoctacyclo[13.13.2.02,10.03,8.011,30.016,24.017,22.025,29]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 13,27-Ditert-butyl-5,19-diphenyl-9,23-dioxaoctacyclo[13.13.2.02,10.03,8.011,30.016,24.017,22.025,29]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene
• 英文别名: 13,27-ditert-butyl-5,19-diphenyl-9,23-dioxaoctacyclo[13.13.2.02,10.03,8.011,30.016,24.017,22.025,29]triaconta-1(29),2(10),3(8),4,6,11,13,15(30),16(24),17(22),18,20,25,27-tetradecaene
• 化学式: C₄₈H₃₈O₂
• 分子量: 646.8
• InChiKey: HXCARXSCDZFELO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.7
• 重原子数：
  50
• 可旋转键数：
  4
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Organic Electroluminescence Element
  申请人：Takaku Koji

  公开号：US20140299851A1

  公开（公告）日：2014-10-09

  An organic electroluminescence element that uses a compound expressed by the following general formula has low inter-molecular interaction and high orientation during vapor deposition, and by using compounds that are resistant to aggregation, luminous efficiency is high, and there is little change in chromaticity accompanying drive deterioration (either V 1 or W 1 and either V 2 or W 2 form rings, the rings formed by V 1 and V 2 are six-membered rings, and the rings formed by W 1 and W 2 are five-membered rings; A 2 to A 4 and A 6 to A 8 represent CR Z or N, and R Z represents a hydrogen atom or a substituent; and R 2 , R 3 , R 7 , and R 8 represent a hydrogen atom, an alkyl group, an aryl group, a heteroaryl group, a fluorine atom, a hydrogen atom [sic], or a deuterium atom.).
• US9608207B2
  申请人：——

  公开号：US9608207B2

  公开（公告）日：2017-03-28