N-(4'-trifluoromethylbiphenyl)phthalimide | 1357113-86-0

• 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: N-(4'-trifluoromethylbiphenyl)phthalimide
• 英文别名: 2-[4-[4-(Trifluoromethyl)phenyl]phenyl]isoindole-1,3-dione；2-[4-[4-(trifluoromethyl)phenyl]phenyl]isoindole-1,3-dione
• CAS: 1357113-86-0
• 化学式: C₂₁H₁₂F₃NO₂
• 分子量: 367.327
• InChiKey: KQLCWQNORKJEJC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  27
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  37.4
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  4-溴苯胺 以 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 生成 N-(4'-trifluoromethylbiphenyl)phthalimide
  参考文献：
  名称：

  Crystal Structures and Triboluminescence Based on Trifluoromethyl and Pentafluorosulfanyl Substituted Asymmetric N-Phenyl Imide Compounds

  摘要：

  A series of asymmetric N-phenyl imides with trifluoromethyl and pentafluorosulfanyl substituents at the terminal phenyl position have been prepared. They are colorless both in solution and the solid state, and they show blue emission in the solid state. X-ray crystal structure analysis of trifluoromethyl and pentafluorosulfanyl substituted derivatives revealed highly ordered noncentrosymmetric molecular arrangements with large net-dipole moments related to the piezoelectric behavior. XRD measurements of the powders afforded intense sharp reflection peaks, indicating formation of the lamellar ordering. By grinding with a spatula, their solids showed vivid blue triboluminescence.

  DOI：

  10.1021/cm202650u

文献信息

• Crystal Structures and Triboluminescence Based on Trifluoromethyl and Pentafluorosulfanyl Substituted Asymmetric <i>N</i>-Phenyl Imide Compounds
  作者：Hikaru Nakayama、Jun-ichi Nishida、Noriyuki Takada、Hiroyasu Sato、Yoshiro Yamashita

  DOI：10.1021/cm202650u

  日期：2012.2.28

  A series of asymmetric N-phenyl imides with trifluoromethyl and pentafluorosulfanyl substituents at the terminal phenyl position have been prepared. They are colorless both in solution and the solid state, and they show blue emission in the solid state. X-ray crystal structure analysis of trifluoromethyl and pentafluorosulfanyl substituted derivatives revealed highly ordered noncentrosymmetric molecular arrangements with large net-dipole moments related to the piezoelectric behavior. XRD measurements of the powders afforded intense sharp reflection peaks, indicating formation of the lamellar ordering. By grinding with a spatula, their solids showed vivid blue triboluminescence.