triacetylene-d2

• 分子结构分类: 有机化合物 - 碳氢化合物 - 不饱和烃
• 英文名称: triacetylene-d2
• 英文别名: d2-Hexatriyne；1,6-dideuteriohexa-1,3,5-triyne
• 化学式: C₆H₂
• 分子量: 76.066
• InChiKey: MZHROOGPARRVHS-QDNHWIQGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  6
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  氘代苯 生成 乙炔-1,2-D2 、 phenyl-d5 、 benzyne-d4 、 triacetylene-d2 、 1,3-hexadien-5-yne-d6 、 fulvene-d6
  参考文献：
  名称：

  Matrix isolation study of the dissociation and isomerization pathways of benzene following corona discharge excitation

  摘要：

  Reactions of C6H6 and C6D6 after exposure to a corona-excited discharge have been studied by the trapping of products into an argon matrix at 14 K. Infrared spectroscopy was employed to identify product species; most were known species and identified by comparison to literature spectra. Tentative assignments for several previously unreported deuterated products are made. The product distribution included species from both rearrangement and dissociation processes. In general, the product distribution differed from previous UV irradiation studies; a mechanism for product formation is proposed. The effectiveness of the corona excitation discharge as a simple source for the generation of transient organic species for matrix spectroscopic study was confirmed.

  DOI：

  10.1021/j100202a018