tris[[4-[3,3'-dihexylsilylene-2,2'-bithiophene]-7-[5′′-n-hexyl-(2,2′;5′,2′′-terthiophene)-5-yl]benzo[c][1,2,5]thiadiazole]-p-phenylene]amine | 1415591-31-9

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: tris[[4-[3,3'-dihexylsilylene-2,2'-bithiophene]-7-[5′′-n-hexyl-(2,2′;5′,2′′-terthiophene)-5-yl]benzo[c][1,2,5]thiadiazole]-p-phenylene]amine
• 英文别名: 4-[7,7-dihexyl-10-[7-[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,1,3-benzothiadiazol-4-yl]-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-N,N-bis[4-[7,7-dihexyl-10-[7-[5-[5-(5-hexylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]-2,1,3-benzothiadiazol-4-yl]-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]phenyl]aniline
• CAS: 1415591-31-9
• 化学式: C₁₅₀H₁₅₉N₇S₁₈Si₃
• 分子量: 2721.4
• InChiKey: RLKWHPRODCEZLX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  51.58
• 重原子数：
  178
• 可旋转键数：
  63
• 环数：
  27.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  507
• 氢给体数：
  0
• 氢受体数：
  25

反应信息

• 作为产物：
  描述：

  4-[3,3'-dihexylsilylene-2,2'-bithiophene]-7-[5′′-n-hexyl-(2,2′;5′,2′′-terthiophene)-5-yl]benzo[c][1,2,5]thiadiazole 、 tris(4-(trimethylstannyl)phenyl)amine 在 四(三苯基膦)钯 作用下， 以 甲苯 为溶剂， 反应 48.0h， 生成 tris[[4-[3,3'-dihexylsilylene-2,2'-bithiophene]-7-[5′′-n-hexyl-(2,2′;5′,2′′-terthiophene)-5-yl]benzo[c][1,2,5]thiadiazole]-p-phenylene]amine
  参考文献：
  名称：

  Planar Star-Shaped Organic Semiconductor with Fused Triphenylamine Core for Solution-Processed Small-Molecule Organic Solar Cells and Field-Effect Transistors

  摘要：

  The symmetrical planar star-shaped organic semiconductor DMM-TPA-[DTS(BTTh3)](3) with fused TPA core donor and three branch motifs, DTS(BTTh3), exhibited efficient p-type semiconducting performance in solution-processed SMOSCs and OFETs compared to the tilted star-shaped TPA-[DTS(BTTh3)](3); a noteworthy PCE value of 4.16% was observed, with a hole mobility and on/off ratio of 7.6 x 10(-3) cm(2) V-1 s(-1) and 5 x 10(6), respectively.

  DOI：

  10.1021/ol303045p

文献信息

• Planar Star-Shaped Organic Semiconductor with Fused Triphenylamine Core for Solution-Processed Small-Molecule Organic Solar Cells and Field-Effect Transistors
  作者：Sanghyun Paek、Nara Cho、Shinuk Cho、Jae Kwan Lee、Jaejung Ko

  DOI：10.1021/ol303045p

  日期：2012.12.21

  The symmetrical planar star-shaped organic semiconductor DMM-TPA-[DTS(BTTh3)](3) with fused TPA core donor and three branch motifs, DTS(BTTh3), exhibited efficient p-type semiconducting performance in solution-processed SMOSCs and OFETs compared to the tilted star-shaped TPA-[DTS(BTTh3)](3); a noteworthy PCE value of 4.16% was observed, with a hole mobility and on/off ratio of 7.6 x 10(-3) cm(2) V-1 s(-1) and 5 x 10(6), respectively.