3-[2,2';5',2'']Terthiophen-5-yl-propionitrile | 761457-78-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 双噻吩和低聚噻吩
• 英文名称: 3-[2,2';5',2'']Terthiophen-5-yl-propionitrile
• 英文别名: 3-[5-(5-Thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanenitrile；3-[5-(5-thiophen-2-ylthiophen-2-yl)thiophen-2-yl]propanenitrile
• CAS: 761457-78-7
• 化学式: C₁₅H₁₁NS₃
• 分子量: 301.457
• InChiKey: VSGNIZVHMHTJNI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  109
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-[2,2';5',2'']Terthiophen-5-yl-propionitrile 在 lithium aluminium tetrahydride 作用下， 以 吡啶 、 乙醚 为溶剂， 反应 87.0h， 生成 {9-[(2R,4S,5R)-4-(tert-Butyl-dimethyl-silanyloxy)-5-(tert-butyl-dimethyl-silanyloxymethyl)-tetrahydro-furan-2-yl]-6-[2-(4-nitro-phenyl)-ethoxy]-9H-purin-2-yl}-(3-[2,2';5',2'']terthiophen-5-yl-propyl)-amine
  参考文献：
  名称：

  Synthesis and properties of terthiophene-modified oligodeoxynucleotides

  摘要：

  Synthesis and properties of oligodeoxynucleotides (ODNs) containing terthiophene (Thp) were described. One-electron oxidation of Thp-modified ODN resulted in the formation of Thp radical cation (Thp(.+)), which remained stable in the experimental time window up to 200 mu s, showing that charge may be carried along DNA by Thp as Thp(.+). (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.07.004
• 作为产物：
  描述：

  2,2':5',2'-四噻吩-5-甲醛 在 palladium on activated charcoal 氢气 作用下， 以 四氢呋喃 、 甲苯 为溶剂， 反应 34.0h， 生成 3-[2,2';5',2'']Terthiophen-5-yl-propionitrile
  参考文献：
  名称：

  Synthesis and properties of terthiophene-modified oligodeoxynucleotides

  摘要：

  Synthesis and properties of oligodeoxynucleotides (ODNs) containing terthiophene (Thp) were described. One-electron oxidation of Thp-modified ODN resulted in the formation of Thp radical cation (Thp(.+)), which remained stable in the experimental time window up to 200 mu s, showing that charge may be carried along DNA by Thp as Thp(.+). (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.07.004

文献信息

• Synthesis and properties of terthiophene-modified oligodeoxynucleotides
  作者：Kiyohiko Kawai、Akira Sugimoto、Hiroko Yoshida、Sachiko Tojo、Mamoru Fujitsuka、Tetsuro Majima

  DOI：10.1016/j.bmcl.2005.07.004

  日期：2005.10

  Synthesis and properties of oligodeoxynucleotides (ODNs) containing terthiophene (Thp) were described. One-electron oxidation of Thp-modified ODN resulted in the formation of Thp radical cation (Thp(.+)), which remained stable in the experimental time window up to 200 mu s, showing that charge may be carried along DNA by Thp as Thp(.+). (c) 2005 Elsevier Ltd. All rights reserved.