acrylic acid 5-[4'-(5-acryloyloxy-pentyl)-2,2'-bipyridinyl-4-yl]-pentyl ester | 371255-40-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: acrylic acid 5-[4'-(5-acryloyloxy-pentyl)-2,2'-bipyridinyl-4-yl]-pentyl ester
• 英文别名: 5-[2-[4-(5-Prop-2-enoyloxypentyl)pyridin-2-yl]pyridin-4-yl]pentyl prop-2-enoate
• CAS: 371255-40-2
• 化学式: C₂₆H₃₂N₂O₄
• 分子量: 436.551
• InChiKey: VPSFPXUWNWCEOW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  32
• 可旋转键数：
  17
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  78.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  ammonium hexafluorophosphate 、 dichlorotetrakis(dimethylsulfoxide)ruthenium(II) 、 acrylic acid 5-[4'-(5-acryloyloxy-pentyl)-2,2'-bipyridinyl-4-yl]-pentyl ester 以 乙醇 、 水 为溶剂， 以70%的产率得到tris-[acrylic acid 5-[4'-(5-acryloyloxy-pentyl)-2,2'-bipyridinyl-4-yl]-pentyl ester]ruthenium(II) hexafluorophosphate
  参考文献：
  名称：

  Tervalent Conducting Polymers with Tailor-Made Work Functions:  Preparation, Characterization, and Applications as Cathodes in Electroluminescent Devices

  摘要：

  A series of conducting polymers have been prepared through thermal polymerization of transition-metal diimine complexes. The as-polymerized material is electrochemically converted into its formally zerovalent form. Due to the proximity of the half-wave potentials of the formal 1+/0 and 0/1 - couples, there is substantial disproportionation of the redox sites at room temperature, resulting in a conductive tervalent mixed-valent material. The redox processes that give rise to this mixed-valent material are predominantly ligand-based, and therefore are highly sensitive to substitution on the ligand periphery. Solution redox chemistry of the monomer can be used to accurately predict the work, function of the corresponding zerovalent conducting polymer, which has been verified by ultraviolet photoelectron spectroscopy. Many of these materials have especially low work functions (<3.6 eV) making them appropriate materials to use as cathode materials in organic light-emitting devices (OLEDs). Working examples of tris(8-hydroxyquinoline)aluminum(III)-based OLEDs have been fabricated using one of these polymers as a cathode.

  DOI：

  10.1021/ja011333e