| 1332831-27-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• CAS: 1332831-27-2
• 化学式: C₂₇H₁₃N
• 分子量: 351.407
• InChiKey: VKSWFNNCJMSDJC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.84
• 重原子数：
  28.0
• 可旋转键数：
  0.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  23.79
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  在 吡啶 、 4-二甲氨基吡啶 、 copper(l) iodide 、 四(三苯基膦)钯 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 5.0h， 生成
  参考文献：
  名称：

  Synthesis and photophysical properties of novel push–pull-type solvatochromic 7-deaza-2′-deoxypurine nucleosides

  摘要：

  We have synthesized two novel push-pull-type fluorescent 7-deazapurine nucleosides, (CNZ)A and (CNZ)G, and investigated their photophysical properties. In particular, (CNZ)A was found to exhibit a remarkable solvatofluorochromicity (Delta lambda(fLmax) = 60 nm). We incorporated (CNZ)A into oligonucleotides and found that (CNZ)A can form a stable base pair with both thymine and cytosine. Such environmentally sensitive fluorescent nucleosides have a potential as a fluorescence sensor for structural studies of nucleic acids. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.06.089
• 作为产物：
  描述：

  4-乙炔基苯甲腈 在 copper(l) iodide 、 四(三苯基膦)钯 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 2.0h， 生成
  参考文献：
  名称：

  Synthesis and photophysical properties of novel push–pull-type solvatochromic 7-deaza-2′-deoxypurine nucleosides

  摘要：

  We have synthesized two novel push-pull-type fluorescent 7-deazapurine nucleosides, (CNZ)A and (CNZ)G, and investigated their photophysical properties. In particular, (CNZ)A was found to exhibit a remarkable solvatofluorochromicity (Delta lambda(fLmax) = 60 nm). We incorporated (CNZ)A into oligonucleotides and found that (CNZ)A can form a stable base pair with both thymine and cytosine. Such environmentally sensitive fluorescent nucleosides have a potential as a fluorescence sensor for structural studies of nucleic acids. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.06.089