1,2,3-triphenyl-1,3-propanedicarbonitrile | 14377-99-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 1,2,3-triphenyl-1,3-propanedicarbonitrile
• 英文别名: 2,3,4-triphenyl-glutaronitrile；2,3,4-Triphenyl-glutaronitril；2,3,4-Triphenylglutarsaeuredinitril；3-Phenyl-2,4-diphenylpentanedinitrile；2,3,4-triphenylpentanedinitrile
• CAS: 14377-99-2
• 化学式: C₂₃H₁₈N₂
• 分子量: 322.409
• InChiKey: AHCAOGGJJQZWIA-UHFFFAOYSA-N

物化性质

• 熔点：
  114 °C
• 沸点：
  483.7±45.0 °C(Predicted)
• 密度：
  1.142±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  47.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1,2,3-triphenyl-1,3-propanedicarbonitrile 在 盐酸 、 乙酰氯 作用下， 生成 2,3,4-triphenyl-glutaric acid-anhydride
  参考文献：
  名称：

  Integrable equations for the partition function of the six-vertex model

  摘要：

  DOI：

  10.1007/bf02675734
• 作为产物：
  描述：

  (E)-2,3-二苯基丙烯腈 、 苯乙腈 在 乙醇 、 sodium ethanolate 作用下， 生成 1,2,3-triphenyl-1,3-propanedicarbonitrile
  参考文献：
  名称：

  Integrable equations for the partition function of the six-vertex model

  摘要：

  DOI：

  10.1007/bf02675734

文献信息

• Water-soluble calixarenes as new inverse phase-transfer catalysts. Their application to aldol-type condensation and Michael addition reactions in water
  作者：Shoichi Shimizu、Seiji Shirakawa、Takashi Suzuki、Yasuyuki Sasaki

  DOI：10.1016/s0040-4020(01)00572-5

  日期：2001.7

  Aldol-type condensation and Michael addition reactions of activated methyl and methylene compounds in aqueous NaOH solution have been developed without the need for any added organic solvents. The water-soluble calix[n]arenes, which contain trimethyl-ammoniomethyl groups on the upper rim, were used as inverse phase-transfer catalysts, resulting in the corresponding products in good to excellent yields. (C) 2001 Elsevier Science Ltd. All rights reserved.
• Solvent-free condensation of arylacetonitrile with aldehydes
  作者：Régis Guillot、André Loupy、Abdelkrim Meddour、Michèle Pellet、Alain Petit

  DOI：10.1016/j.tet.2005.07.040

  日期：2005.10

  The condensation of a series of arylacetonitriles with aldehydes can be carried out by mixing equivalent amounts of reagents with neat powdered KOH at room temperature for 3-60 min depending on the aldehyde steric hindrance. At higher temperature (110 degrees C), yields were generally higher and purity increased within very short reaction times (1-5 min). With pentamethylphenylacetonitrile, a phase transfer agent was necessary to give a satisfactory yield. (c) 2005 Elsevier Ltd. All rights reserved.