(3,3'''-didodecyl-[2,2':5',2'':5'',2'''-quaterthiophen]-5-yl)methanol | 1384110-16-0

• 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: (3,3'''-didodecyl-[2,2':5',2'':5'',2'''-quaterthiophen]-5-yl)methanol
• CAS: 1384110-16-0
• 化学式: C₄₁H₆₀OS₄
• 分子量: 697.191
• InChiKey: HFGIGNUWKNRHKX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.35
• 重原子数：
  46.0
• 可旋转键数：
  26.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  20.23
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  均苯四甲酸二胺 、 (3,3'''-didodecyl-[2,2':5',2'':5'',2'''-quaterthiophen]-5-yl)methanol 在 偶氮二甲酸二异丙酯 、 三苯基膦 作用下， 以 四氢呋喃 为溶剂， 以38%的产率得到2,6-bis((3,3'''-didodecyl-[2,2':5',2'':5'',2'''-quaterthiophen]-5-yl)methyl)pyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetraone
  参考文献：
  名称：

  Bridged 3,3″′-didodecylquaterthiophene-based dimers: design, synthesis, and optoelectronic properties

  摘要：

  Five functionalized quaterthiophene dimers including a non-conjugated bridge have been designed and efficiently synthesized. The synthetic pathways explored toward these dimers revealed unexpected features, such as the direct formation of secondary and tertiary quaterthiophene amines through a procedure initially developed for the preparation of primary amine exclusively. All these dimers possess a promising potential for the elaboration of semiconducting materials with a charge transport of higher dimensionality compared to quaterthiophene. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.04.072
• 作为产物：
  描述：

  5,5′-双(3-十二烷基-2-噻吩基)-2,2′-联噻吩 在 sodium tetrahydroborate 、 三氯氧磷 作用下， 以 甲醇 、 1,2-二氯乙烷 、 甲苯 为溶剂， 反应 26.0h， 生成 (3,3'''-didodecyl-[2,2':5',2'':5'',2'''-quaterthiophen]-5-yl)methanol
  参考文献：
  名称：

  Bridged 3,3″′-didodecylquaterthiophene-based dimers: design, synthesis, and optoelectronic properties

  摘要：

  Five functionalized quaterthiophene dimers including a non-conjugated bridge have been designed and efficiently synthesized. The synthetic pathways explored toward these dimers revealed unexpected features, such as the direct formation of secondary and tertiary quaterthiophene amines through a procedure initially developed for the preparation of primary amine exclusively. All these dimers possess a promising potential for the elaboration of semiconducting materials with a charge transport of higher dimensionality compared to quaterthiophene. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2012.04.072