6-(ferrocenylvinylidene)-4-hydroxycyclohexa-2,4-dien-1-one | 323203-10-7

• 英文名称: 6-(ferrocenylvinylidene)-4-hydroxycyclohexa-2,4-dien-1-one
• CAS: 323203-10-7
• 化学式: C₁₈H₁₄FeO₂
• 分子量: 318.155
• InChiKey: QOUWMJVRZUBDBS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  三氟甲磺酸 、 6-(ferrocenylvinylidene)-4-hydroxycyclohexa-2,4-dien-1-one 以 乙腈 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of a Vinylene-Bridged Ferrocene−Hydroquinone Complex and Its Unusual Structural Change Originated by Proton-Coupled Electron Transfer

  摘要：

  The vinylene-bridged ferrocene-hydroquinone complex, 2-(2-ferrocenylvinyl)hydroquinone, 1. underwent 2-electron oxidation and 2-proton elimination by a redox reaction with 1,1'-dichloroferrocenium hexafluorophosphate as a 1-electron oxidizing agent in methanol to form 3, which includes a novel allene and a quinonoid structure. The quinonoid compound 3 shows interesting proton response to generate a semiquinone-ferrocenium compound 2-1 through proton-coupled intramolecular electron transfer in acetonitrile.

  DOI：

  10.1021/ic0008161
• 作为产物：
  描述：

  2-(2-ferrocenylvinyl)hydroquinone 在 (Fe(η5-C5H4Cl)2)(PF6) 作用下， 以 甲醇 为溶剂， 生成 6-(ferrocenylvinylidene)-4-hydroxycyclohexa-2,4-dien-1-one
  参考文献：
  名称：

  Synthesis of a Vinylene-Bridged Ferrocene−Hydroquinone Complex and Its Unusual Structural Change Originated by Proton-Coupled Electron Transfer

  摘要：

  The vinylene-bridged ferrocene-hydroquinone complex, 2-(2-ferrocenylvinyl)hydroquinone, 1. underwent 2-electron oxidation and 2-proton elimination by a redox reaction with 1,1'-dichloroferrocenium hexafluorophosphate as a 1-electron oxidizing agent in methanol to form 3, which includes a novel allene and a quinonoid structure. The quinonoid compound 3 shows interesting proton response to generate a semiquinone-ferrocenium compound 2-1 through proton-coupled intramolecular electron transfer in acetonitrile.

  DOI：

  10.1021/ic0008161