2-butyloctanoic acid 1-([2,2']bithiophen-5-yl)propyl ester | 672965-31-0

• 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: 2-butyloctanoic acid 1-([2,2']bithiophen-5-yl)propyl ester
• 英文别名: 1-([2,2'-Bithiophen]-5-yl)propyl 2-butyloctanoate；1-(5-thiophen-2-ylthiophen-2-yl)propyl 2-butyloctanoate
• CAS: 672965-31-0
• 化学式: C₂₃H₃₄O₂S₂
• 分子量: 406.654
• InChiKey: LZXWCFOEOGMESM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.6
• 重原子数：
  27
• 可旋转键数：
  14
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  82.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-butyloctanoic acid 1-([2,2']bithiophen-5-yl)propyl ester 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 1.0h， 以92%的产率得到2-butyloctanoic acid 1-(5'-bromo-[2,2']bithiophen-5-yl)propyl ester
  参考文献：
  名称：

  Organic Thin Film Transistors from a Soluble Oligothiophene Derivative Containing Thermally Removable Solubilizing Groups

  摘要：

  A symmetrical alpha,omega-substituted sexithiophene derivative containing thermally removable branched ester solubilizing groups has been prepared. These oligomers can be solution cast into thin films and then thermolyzed to remove the solubilizing group, leaving short pendant alkene groups on the oligomer. Device testing of thin film transistors shows an increase in hole mobility from 1 x 10-5 cm2/(V s) with on/off ratios of approximately 100 before thermolysis to 5 x 10-2 cm2/(V s) with on/off ratios >105 after thermolysis. This method offers an attractive route to easily processed and highly performing thiophene oligomers.

  DOI：

  10.1021/ja039529x
• 作为产物：
  描述：

  2,2'-联二噻吩 在 吡啶 、 4-二甲氨基吡啶 、 lithium aluminium tetrahydride 、 四氯化锡 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 5.0h， 生成 2-butyloctanoic acid 1-([2,2']bithiophen-5-yl)propyl ester
  参考文献：
  名称：

  Organic Thin Film Transistors from a Soluble Oligothiophene Derivative Containing Thermally Removable Solubilizing Groups

  摘要：

  A symmetrical alpha,omega-substituted sexithiophene derivative containing thermally removable branched ester solubilizing groups has been prepared. These oligomers can be solution cast into thin films and then thermolyzed to remove the solubilizing group, leaving short pendant alkene groups on the oligomer. Device testing of thin film transistors shows an increase in hole mobility from 1 x 10-5 cm2/(V s) with on/off ratios of approximately 100 before thermolysis to 5 x 10-2 cm2/(V s) with on/off ratios >105 after thermolysis. This method offers an attractive route to easily processed and highly performing thiophene oligomers.

  DOI：

  10.1021/ja039529x

文献信息

• [EN] [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME<br/>[FR] COMPOSÉ DE [1]BENZOTHIÉNO[3,2-B][1]BENZOTHIOPHÈNE ET SON PROCÉDÉ DE FABRICATION ET DISPOSITIF ÉLECTRONIQUE ORGANIQUE L'UTILISANT
  申请人：RICOH KK

  公开号：WO2009128559A1

  公开（公告）日：2009-10-22

  A [1]benzothieno[3,2-b][1]benzothiophene compound expressed by General Formula (I): General Formula (I) where X and Y are each independently a hydrogen atom; a halogen atom; or a functional group having a straight or branched aliphatic alkyl group optionally having a halogen atom, a functional group having an alicyclic alkyl group optionally having a halogen atom, a functional group having a straight or branched aliphatic alkenyl group optionally having a halogen atom, a functional group having an alicyclic alkenyl group optionally having a halogen atom, a functional group having a carboxyl group, or a functional group having a thiol group, as a partial structure; and X and Y are the same or each independently different, provided that at least one of X and Y has a straight or branched aliphatic alkenyl group, an alicyclic alkenyl group, a carboxyl group or a thiol group, as a partial structure.

  一种由通用式（I）表示的[1]苯并噻吩[3,2-b][1]苯并噻吩化合物：通用式（I），其中X和Y分别是氢原子；卤素原子；或具有直链或支链脂肪族烷基基团，可选择地具有卤素原子，具有脂环烷基基团，可选择地具有卤素原子，具有直链或支链烯基基团，可选择地具有卤素原子，具有脂环烯基基团，可选择地具有卤素原子，具有羧基，或具有硫醇基的功能基团，作为部分结构；且X和Y相同或各自独立不同，但X和Y中至少有一个具有直链或支链烯基基团，脂环烯基基团，羧基或硫醇基，作为部分结构。
• [1]BENZOTHIENO[3,2-B][1]BENZOTHIOPHENE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME
  申请人：Ricoh Company, Ltd.

  公开号：EP2265619B1

  公开（公告）日：2016-06-22
• US8440713B2
  申请人：——

  公开号：US8440713B2

  公开（公告）日：2013-05-14
• Organic Thin Film Transistors from a Soluble Oligothiophene Derivative Containing Thermally Removable Solubilizing Groups
  作者：Amanda R. Murphy、Jean M. J. Fréchet、Paul Chang、Josephine Lee、Vivek Subramanian

  DOI：10.1021/ja039529x

  日期：2004.2.1

  A symmetrical alpha,omega-substituted sexithiophene derivative containing thermally removable branched ester solubilizing groups has been prepared. These oligomers can be solution cast into thin films and then thermolyzed to remove the solubilizing group, leaving short pendant alkene groups on the oligomer. Device testing of thin film transistors shows an increase in hole mobility from 1 x 10-5 cm2/(V s) with on/off ratios of approximately 100 before thermolysis to 5 x 10-2 cm2/(V s) with on/off ratios >105 after thermolysis. This method offers an attractive route to easily processed and highly performing thiophene oligomers.