2-(3-cyclohexylidene-1,4-benzodioxin-2-yl)-N,N-dimethylacetamide | 137724-99-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并二恶烷
• 英文名称: 2-(3-cyclohexylidene-1,4-benzodioxin-2-yl)-N,N-dimethylacetamide
• CAS: 137724-99-3
• 化学式: C₁₈H₂₃NO₃
• 分子量: 301.386
• InChiKey: AAJZAKLOHVMQNA-UHFFFAOYSA-N

物化性质

• 沸点：
  452.6±44.0 °C(Predicted)
• 密度：
  1.147±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  38.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(3-cyclohexylidene-1,4-benzodioxin-2-yl)-N,N-dimethylacetamide 以76%的产率得到
  参考文献：
  名称：

  Moreau Pascale, Guillaumet Gerald, Coudert Gerard, Synth. Commun, 24 (1994) N 13, S 1781-1787

  摘要：

  DOI：
• 作为产物：
  描述：

  1,1-二甲氧基-N,N-二甲基乙胺 、 2-(1-Hydroxy-l-cyclohexyl)-1,4-benzodioxin 以 xylene 为溶剂， 反应 96.0h， 以53%的产率得到2-(3-cyclohexylidene-1,4-benzodioxin-2-yl)-N,N-dimethylacetamide
  参考文献：
  名称：

  Synthesis of 1,3-dienes bearing both electron-donor and acceptor substituents

  摘要：

  Allylic benzodioxinic alcohols were prepared from 1,4-benzodioxin and then submitted to the orthoester Claisen rearrangement and Eschenmoser procedure leading to 3-substituted-2-alkylidene-1,4-benzodioxans. Di-and trisubstituted 1,3-dienes bearing both electron-donor and acceptor substituents were obtained in good yields from these compounds.

  DOI：

  10.1016/0040-4039(91)80074-g

文献信息

• Moreau Pascale, Guillaumet Gerald, Coudert Gerard, Synth. Commun, 24 (1994) N 13, S 1781-1787
  作者：Moreau Pascale, Guillaumet Gerald, Coudert Gerard

  DOI：——

  日期：——
• A Convenient Synthesis of Diversely Substituted N,N-Dimethyl-4-oxo-2-(<i>E</i>)-alkenamides
  作者：Pascale Moreau、Gérard Guillaumet、Gérard Coudert

  DOI：10.1080/00397919408010185

  日期：1994.7

  An efficient synthesis of diversely substituted N,N-dimethyl-4-oxo-2-(E)-alkenamides is reported. These derivatives were obtained in three steps from 1,4-benzodioxin with fair to good yields.
• Synthesis of 1,3-dienes bearing both electron-donor and acceptor substituents
  作者：P. Moreau、M. Al Neirabeyeh、G. Guillaumet、G. Coudert

  DOI：10.1016/0040-4039(91)80074-g

  日期：1991.9

  Allylic benzodioxinic alcohols were prepared from 1,4-benzodioxin and then submitted to the orthoester Claisen rearrangement and Eschenmoser procedure leading to 3-substituted-2-alkylidene-1,4-benzodioxans. Di-and trisubstituted 1,3-dienes bearing both electron-donor and acceptor substituents were obtained in good yields from these compounds.