N-(amino)-1,6-bis-(3,5-di-tert-butylphenoxy)-9-(N-pyrrolidinyl)perylene-3,4-dicarboximide | 358762-73-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: N-(amino)-1,6-bis-(3,5-di-tert-butylphenoxy)-9-(N-pyrrolidinyl)perylene-3,4-dicarboximide
• CAS: 358762-73-9
• 化学式: C₅₄H₅₉N₃O₄
• 分子量: 814.08
• InChiKey: RODOLDYFSDSPMS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.58
• 重原子数：
  61.0
• 可旋转键数：
  5.0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  85.1
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  N-(amino)-1,6-bis-(3,5-di-tert-butylphenoxy)-9-(N-pyrrolidinyl)perylene-3,4-dicarboximide 、 7-octyl-1H-isochromeno[6,5,4-def]isoquinoline-1,3,6,8(7H)-tetraone 以 N-甲基吡咯烷酮 为溶剂， 反应 30.0h， 以46%的产率得到
  参考文献：
  名称：

  Photorefractivity in Nematic Liquid Crystals Using a Donor−Acceptor Dyad with a Low-Lying Excited Singlet State for Charge Generation

  摘要：

  The photorefractive effect was observed in room-temperature nematic liquid crystal composites consisting of a eutectic mixture of 65% 4 '-(n-pentyl)-4-cyanobiphenyl and 35% 4 '-(n-octyloxy)-4-cyanobiphenyl doped with a donor-acceptor dyad in which 9-(N-pyrrolidinyl)perylene-3,4-dicarboximide is directly linked to 1,8: 4,5-naphthalenetetracarboxydiimide. This dyad has a broad, intense absorption band that extends from 500 to 750 nm. Measurements of two-beam asymmetric energy exchange (beam-coupling) and the diffraction efficiency of the refractive index grating produced in these liquid crystal thin films were carried out. A comparison is made between the covalent donor-acceptor dyad and the corresponding noncovalent donor-acceptor pair. In each case the covalent dyad outperforms the noncovalent donor-acceptor pair. The results show that aminoaryleneimides are promising new charge donating chromophores that are capable of extending photorefractive performance of nematic liquid crystal composites into the near-infrared region of the spectrum.

  DOI：

  10.1021/jp011561v
• 作为产物：
  描述：

  1,6,9-tribromo-N-(2,5-di-tert-butylphenyl)perylene-3,4-dicarboximide 在 氢氧化钾 、 copper(l) iodide 作用下， 以 N-甲基吡咯烷酮 、 乙酸乙酯 、 甲苯 、 叔丁醇 为溶剂， 反应 28.5h， 生成 N-(amino)-1,6-bis-(3,5-di-tert-butylphenoxy)-9-(N-pyrrolidinyl)perylene-3,4-dicarboximide
  参考文献：
  名称：

  Photorefractivity in Nematic Liquid Crystals Using a Donor−Acceptor Dyad with a Low-Lying Excited Singlet State for Charge Generation

  摘要：

  The photorefractive effect was observed in room-temperature nematic liquid crystal composites consisting of a eutectic mixture of 65% 4 '-(n-pentyl)-4-cyanobiphenyl and 35% 4 '-(n-octyloxy)-4-cyanobiphenyl doped with a donor-acceptor dyad in which 9-(N-pyrrolidinyl)perylene-3,4-dicarboximide is directly linked to 1,8: 4,5-naphthalenetetracarboxydiimide. This dyad has a broad, intense absorption band that extends from 500 to 750 nm. Measurements of two-beam asymmetric energy exchange (beam-coupling) and the diffraction efficiency of the refractive index grating produced in these liquid crystal thin films were carried out. A comparison is made between the covalent donor-acceptor dyad and the corresponding noncovalent donor-acceptor pair. In each case the covalent dyad outperforms the noncovalent donor-acceptor pair. The results show that aminoaryleneimides are promising new charge donating chromophores that are capable of extending photorefractive performance of nematic liquid crystal composites into the near-infrared region of the spectrum.

  DOI：

  10.1021/jp011561v