hept-6-enoic acid [2-(3-allyl-4,5-dimethoxy-phenyl)ethyl]amide | 1072928-19-8

• 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: hept-6-enoic acid [2-(3-allyl-4,5-dimethoxy-phenyl)ethyl]amide
• 英文别名: N-[2-(3,4-dimethoxy-5-prop-2-enylphenyl)ethyl]hept-6-enamide
• CAS: 1072928-19-8
• 化学式: C₂₀H₂₉NO₃
• 分子量: 331.455
• InChiKey: KSWKCJZLPKPJPC-UHFFFAOYSA-N

物化性质

• 沸点：
  501.1±50.0 °C(Predicted)
• 密度：
  1.000±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  24
• 可旋转键数：
  12
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  47.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  hept-6-enoic acid [2-(3-allyl-4,5-dimethoxy-phenyl)ethyl]amide 在 三氯氧磷 作用下， 以 乙腈 为溶剂， 反应 1.0h， 以95%的产率得到1-Hex-5-enyl-6,7-dimethoxy-8-prop-2-enyl-3,4-dihydroisoquinoline
  参考文献：
  名称：

  A combined RCM-Bischler–Napieralski strategy towards the synthesis of the carbon skeleton of excentricine and related stephaoxocanes

  摘要：

  A convenient synthetic approach to a cyclodeca[ij]isoquinoline derivative, which embodies the carbon skeleton of excentricine and related stephaoxocanes, is described. The synthesis involves the combined use of ring closing metathesis and Bischler-Napieralski cyclizations for the construction of the homocyclic and nitrogen-bearing rings, respectively. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.08.005
• 作为产物：
  描述：

  6-庚烯酸 、 2-(3-allyl-4,5-dimethoxy-phenyl)ethylamine 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 15.0h， 以54%的产率得到hept-6-enoic acid [2-(3-allyl-4,5-dimethoxy-phenyl)ethyl]amide
  参考文献：
  名称：

  A combined RCM-Bischler–Napieralski strategy towards the synthesis of the carbon skeleton of excentricine and related stephaoxocanes

  摘要：

  A convenient synthetic approach to a cyclodeca[ij]isoquinoline derivative, which embodies the carbon skeleton of excentricine and related stephaoxocanes, is described. The synthesis involves the combined use of ring closing metathesis and Bischler-Napieralski cyclizations for the construction of the homocyclic and nitrogen-bearing rings, respectively. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.08.005

文献信息

• A combined RCM-Bischler–Napieralski strategy towards the synthesis of the carbon skeleton of excentricine and related stephaoxocanes
  作者：Enrique L. Larghi、Teodoro S. Kaufman

  DOI：10.1016/j.tet.2008.08.005

  日期：2008.10

  A convenient synthetic approach to a cyclodeca[ij]isoquinoline derivative, which embodies the carbon skeleton of excentricine and related stephaoxocanes, is described. The synthesis involves the combined use of ring closing metathesis and Bischler-Napieralski cyclizations for the construction of the homocyclic and nitrogen-bearing rings, respectively. (C) 2008 Elsevier Ltd. All rights reserved.