2-[2-[4-[2-(2-Oxocyclohexyl)ethyl]phenyl]ethyl]cyclohexan-1-one | 130800-13-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-[2-[4-[2-(2-Oxocyclohexyl)ethyl]phenyl]ethyl]cyclohexan-1-one
• CAS: 130800-13-4
• 化学式: C₂₂H₃₀O₂
• 分子量: 326.479
• InChiKey: FNNJOHOZJWYANP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  24
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-[2-[4-[2-(2-Oxocyclohexyl)ethyl]phenyl]ethyl]cyclohexan-1-one 在 邻四氯苯醌 、 甲烷磺酸 作用下， 生成 二苯并[a,h]蒽
  参考文献：
  名称：

  A new general synthesis of polycyclic aromatic compounds based on enamine chemistry

  摘要：

  Alkylation of enamines and enamine salts by benzylic and (beta-haloethyl)aryl halides, respectively, followed by acidic cyclodehydration and dehydrogenation provides an efficient synthetic approach to a wide range of polycyclic aromatic compounds of diverse structural types. Specific polycyclic hydrocarbons synthesized by this route include benzo[a]- and benzo[c]fluorene, 7H-dibenzo[c,g]-, 13H-dibenzo[a,i]-, and 13H-dibenzo[a,g]fluorene, 15H-tribenzo[a,c,i]fluorene, dibenzo[b,def]chrysene, benzo[rst]pentaphene, indeno[1,2-b]fluorene, fluoreno[3,4-c]fluorene, octahydrodibenz[a,j]anthracene, dibenz[a,j]anthracene, octahydrodibenz[a,h]anthracene, dibenz[a,h]anthracene, dibenz[a,h]anthracene, picene, benzo[c]picene, 1H-benz[bc]aceanthrylene, and 4H-cyclopenta[def]chrysene. This method with appropriate modifications appears to be potentially broader in scope than established traditional methods of polycyclic hydrocarbon synthesis.

  DOI：

  10.1021/jo00003a050
• 作为产物：
  描述：

  1,4-苯二乙酸 在 lithium aluminium tetrahydride 、 乙基溴化镁 、 三乙胺 、 sodium iodide 作用下， 以 四氢呋喃 、 丙酮 为溶剂， 反应 3.0h， 生成 2-[2-[4-[2-(2-Oxocyclohexyl)ethyl]phenyl]ethyl]cyclohexan-1-one
  参考文献：
  名称：

  A new general synthesis of polycyclic aromatic compounds based on enamine chemistry

  摘要：

  Alkylation of enamines and enamine salts by benzylic and (beta-haloethyl)aryl halides, respectively, followed by acidic cyclodehydration and dehydrogenation provides an efficient synthetic approach to a wide range of polycyclic aromatic compounds of diverse structural types. Specific polycyclic hydrocarbons synthesized by this route include benzo[a]- and benzo[c]fluorene, 7H-dibenzo[c,g]-, 13H-dibenzo[a,i]-, and 13H-dibenzo[a,g]fluorene, 15H-tribenzo[a,c,i]fluorene, dibenzo[b,def]chrysene, benzo[rst]pentaphene, indeno[1,2-b]fluorene, fluoreno[3,4-c]fluorene, octahydrodibenz[a,j]anthracene, dibenz[a,j]anthracene, octahydrodibenz[a,h]anthracene, dibenz[a,h]anthracene, dibenz[a,h]anthracene, picene, benzo[c]picene, 1H-benz[bc]aceanthrylene, and 4H-cyclopenta[def]chrysene. This method with appropriate modifications appears to be potentially broader in scope than established traditional methods of polycyclic hydrocarbon synthesis.

  DOI：

  10.1021/jo00003a050

文献信息

• Compound, material for organic electroluminescent elements, organic electroluminescent element and electronic device
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US10297757B2

  公开（公告）日：2019-05-21

  An organic electroluminescence device having higher performance, in particular exhibiting a better driving voltage and a better external quantum efficiency, while having an extended lifetime; and an electronic equipment provided with the organic electroluminescence device are provided. In addition, a compound for realizing the same device and equipment is provided. Specifically, a compound having a specific structure having a triphenylene skeleton; an organic electroluminescence device using the compound; and an electronic equipment provided with the organic electroluminescence device were provided.

  本发明提供了一种性能更高的有机电致发光器件，特别是具有更好的驱动电压和外部量子效率，同时具有更长的使用寿命；还提供了一种配备该有机电致发光器件的电子设备。此外，还提供了一种用于实现相同装置和设备的化合物。具体而言，提供了一种具有特定结构的化合物，其骨架为三亚苯；一种使用该化合物的有机电致发光器件；以及一种配备该有机电致发光器件的电子设备。
• HARYEY, RONALD G.;PATAKI, JOHN;CORTEZ, CECILIA;DI, RADDO PASQUALE;YANG, C+, J. ORG. CHEM., 56,(1991) N, C. 1210-1217
  作者：HARYEY, RONALD G.、PATAKI, JOHN、CORTEZ, CECILIA、DI, RADDO PASQUALE、YANG, C+

  DOI：——

  日期：——
• COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US20160343950A1

  公开（公告）日：2016-11-24

  An organic electroluminescence device having higher performance, in particular exhibiting a better driving voltage and a better external quantum efficiency, while having an extended lifetime; and an electronic equipment provided with the organic electroluminescence device are provided. In addition, a compound for realizing the same device and equipment is provided. Specifically, a compound having a specific structure having a triphenylene skeleton; an organic electroluminescence device using the compound; and an electronic equipment provided with the organic electroluminescence device were provided.