| 1392979-05-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• CAS: 1392979-05-3
• 化学式: C₈₀H₂₇N₃O₂
• 分子量: 1062.11
• InChiKey: MPESYPFYAKNJBA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  20.33
• 重原子数：
  85.0
• 可旋转键数：
  12.0
• 环数：
  35.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  57.01
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  己基叠氮化物 、 [6,6]-phenyl-C61 butyric acid propargyl ester 在 五甲基二乙烯三胺 、 copper(I) bromide 作用下， 以 甲苯 为溶剂， 反应 24.0h， 生成 、
  参考文献：
  名称：

  Controlled Synthesis of Fullerene-Attached Poly(3-alkylthiophene)-Based Copolymers for Rational Morphological Design in Polymer Photovoltaic Devices

  摘要：

  Poly(3-alkylthiophene)-based diblock copolymers with controllable block lengths were synthesized by combining the Grignard metathesis method, Ni-catalyzed quasi-living polymerization, and a subsequent azide-alkyne click reaction to introduce a fullerene functionality into the side chains of one of the blocks. The fiillerene-attached copolymers had good solubility (>30 g L-1 chlorobenzene) with high molecular weights (M-n > 20 000). The diblock copolymer films formed clear nanostructures with sizes of ca. 20 nm, driven by crystallization of the poly(3-hexylthiophene) block and aggregation of the fullerene groups, as observed in AFM phase images. The copolymer-based photovoltaic device showed a power conversion efficiency of 2.5%, with a much higher fill factor of 0.63 in comparison to the previously reported single component devices. These results indicate that rational material designs enable the construction of suitable donor-acceptor nanostructures for photovoltaic applications, without relying on the mixing of materials.

  DOI：

  10.1021/ma300376m