1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione | 1616509-88-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: 1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione
• CAS: 1616509-88-6
• 化学式: C₁₅H₁₅N₃O₃
• 分子量: 285.302
• InChiKey: BCPCGNNDSJLHCJ-UHFFFAOYSA-N

物化性质

• 沸点：
  445.8±35.0 °C(Predicted)
• 密度：
  1.088±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  60.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  金刚烷胺 、 1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione 、 1-(4-碘苯基)吡咯 在 tris-(dibenzylideneacetone)dipalladium(0) 、 三(2-呋喃基)膦 、 potassium carbonate 作用下， 以 乙腈 为溶剂， 反应 2.0h， 以85%的产率得到1,3,5-tris[(2Z)-3-[4-(1H-pyrrol-1-yl)phenyl]-4-(tricyclo[3.3.1.1^3,7]dec-1-ylamino)but-2-en-1-yl]-1,3,5-triazinane-2,4,6-trione
  参考文献：
  名称：

  Participation of compact planar 1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione in Pd(0) catalysed seven component cascade reactions delivers novel tunable molecular architecture

  摘要：

  We report the spatially controlled, protecting group free, catalytic assembly of a library of nineteen 7-component cascade products generated from a novel planar trisallenyl 1,3,5-triazinane-2,4,6-trione core in combination with aryl iodides and amines with excellent regio and good stereoaselectivity for Z,Z,Z-isomers. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2014.05.025
• 作为产物：
  描述：

  聚合甲醛 、 1,3,5-tri(prop-2-yn-1-yl)-1,3,5-triazinane-2,4,6-trione 在 copper(l) iodide 、 二环己胺 作用下， 以 1,4-二氧六环 为溶剂， 反应 3.0h， 以59%的产率得到1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione
  参考文献：
  名称：

  Participation of compact planar 1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione in Pd(0) catalysed seven component cascade reactions delivers novel tunable molecular architecture

  摘要：

  We report the spatially controlled, protecting group free, catalytic assembly of a library of nineteen 7-component cascade products generated from a novel planar trisallenyl 1,3,5-triazinane-2,4,6-trione core in combination with aryl iodides and amines with excellent regio and good stereoaselectivity for Z,Z,Z-isomers. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2014.05.025

文献信息

• Participation of compact planar 1,3,5-tri(buta-2,3-dien-1-yl)-1,3,5-triazinane-2,4,6-trione in Pd(0) catalysed seven component cascade reactions delivers novel tunable molecular architecture
  作者：Zeynep Gültekin、Elghareeb E. Elboray、Moustafa F. Aly、Hussien H. Abbas-Temirek、Helena J. Shepherd、Ronald Grigg

  DOI：10.1016/j.tet.2014.05.025

  日期：2014.8

  We report the spatially controlled, protecting group free, catalytic assembly of a library of nineteen 7-component cascade products generated from a novel planar trisallenyl 1,3,5-triazinane-2,4,6-trione core in combination with aryl iodides and amines with excellent regio and good stereoaselectivity for Z,Z,Z-isomers. (C) 2014 Elsevier Ltd. All rights reserved.