4-(5-hexylthiophen-2-yl)-2,6-bis(3-trifluoromethyl-1H-pyrazol-5-yl)pyridine | 1289477-04-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯并吡啶类
• 英文名称: 4-(5-hexylthiophen-2-yl)-2,6-bis(3-trifluoromethyl-1H-pyrazol-5-yl)pyridine
• 英文别名: 4-(5-hexylthiophen-2-yl)-2,6-bis[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine
• CAS: 1289477-04-8
• 化学式: C₂₃H₂₁F₆N₅S
• 分子量: 513.51
• InChiKey: KKMSCUVOYQLGHD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  35
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  98.5
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  trichloro(4,4',4"-trimethoxysilanecarbonyl-2,2';2",6-terpyridine)ruthenium(II) 、 4-(5-hexylthiophen-2-yl)-2,6-bis(3-trifluoromethyl-1H-pyrazol-5-yl)pyridine 在 H₂O 作用下， 以 乙醇 为溶剂， 以67%的产率得到
  参考文献：
  名称：

  钌（II）敏化剂与染料敏化太阳能电池的三齿螯合剂

  摘要：

  Ru的两个新特性：前所未有的Ru II敏化剂由两个三齿配体，一个三羧基吡啶和一个带有扩展的π-共轭辅助色素的双阴离子双（吡唑基）吡啶衍生物配合使用（见图，Ru品红色，N蓝色，O红色，F绿色，S黄色，C灰色）。新一代不含硫氰酸盐的Ru II敏化剂可在染料敏化太阳能电池中提供高达η = 10.7％的太阳能转化效率。

  DOI：

  10.1002/anie.201006629
• 作为产物：
  描述：

  在 sodium ethanolate 、 肼 作用下， 以 四氢呋喃 、 乙醇 为溶剂， 生成 4-(5-hexylthiophen-2-yl)-2,6-bis(3-trifluoromethyl-1H-pyrazol-5-yl)pyridine
  参考文献：
  名称：

  钌（II）敏化剂与染料敏化太阳能电池的三齿螯合剂

  摘要：

  Ru的两个新特性：前所未有的Ru II敏化剂由两个三齿配体，一个三羧基吡啶和一个带有扩展的π-共轭辅助色素的双阴离子双（吡唑基）吡啶衍生物配合使用（见图，Ru品红色，N蓝色，O红色，F绿色，S黄色，C灰色）。新一代不含硫氰酸盐的Ru II敏化剂可在染料敏化太阳能电池中提供高达η = 10.7％的太阳能转化效率。

  DOI：

  10.1002/anie.201006629

文献信息

• PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION, AND TERPYRIDINE COMPOUND OR ESTERIFIED PRODUCT THEREOF
  申请人：FUJIFILM Corporation

  公开号：US20170092435A1

  公开（公告）日：2017-03-30

  A photoelectric conversion element having an electrically conductive support, a photoconductor layer including an electrolyte, a charge transfer layer including an electrolyte, and a counter electrode, in which the photoconductor layer has semiconductor fine particles carrying a metal complex dye represented by the following Formula (1), and a dye-sensitized solar cell; and a metal complex dye, a dye solution, and a terpyridine compound, or an esterified product thereof, each of which is used in the photoelectric conversion element and the dye-sensitized solar cell, ML1L2(X) n1 .CI mY Formula (1) in Formula (1), M represents a metal ion, L1 represents a tridentate ligand having a group L represented by the following Formula (LV-1) or (LV-2); L2 represents a bidentate or tridentate ligand which coordinates to M with an anion, in which a ring including a ring-constituting nitrogen atom which coordinates to M with an lone electron pair has an organic group R VL : -(R VL )n VL ; X represents a monodentate ligand; n1 represents 0 or 1; CI represents a required counterion; and mY represents an integer of 0 to 3, -R V1 =R V2 -R V3 Formula (LV-1) —C≡C—R V3 Formula (LV-2) in the formulae, R V1 and R V2 each independently represent a nitrogen atom or CR V4 , R V4 represents a hydrogen atom or a substituent, and R V3 represents an aryl group or a heteroaryl group; R VL represents a specific aromatic ring group or the like; and n VL represents an integer of 0 or more.