Methyl 5-[33-(5-ethylthiophen-2-yl)-33-heptadecacyclo[9.7.7.719,25.413,17.321,23.111,25.03,31.05,30.07,28.09,26.015,38.020,37.022,39.024,40.027,34.029,35.032,36]tetraconta-1(18),3,5,7,9,13(40),14,17(37),19,21,23,26,28,30,32(36),34,38-heptadecaenyl]pentanoate

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: Methyl 5-[33-(5-ethylthiophen-2-yl)-33-heptadecacyclo[9.7.7.719,25.413,17.321,23.111,25.03,31.05,30.07,28.09,26.015,38.020,37.022,39.024,40.027,34.029,35.032,36]tetraconta-1(18),3,5,7,9,13(40),14,17(37),19,21,23,26,28,30,32(36),34,38-heptadecaenyl]pentanoate
• 英文别名: methyl 5-[33-(5-ethylthiophen-2-yl)-33-heptadecacyclo[9.7.7.719,25.413,17.321,23.111,25.03,31.05,30.07,28.09,26.015,38.020,37.022,39.024,40.027,34.029,35.032,36]tetraconta-1(18),3,5,7,9,13(40),14,17(37),19,21,23,26,28,30,32(36),34,38-heptadecaenyl]pentanoate
• 化学式: C₅₂H₃₀O₂S
• 分子量: 718.9
• InChiKey: ULYIHWXAFRIKNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  55
• 可旋转键数：
  8
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  54.5
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• PHOTOELECTRIC CONVERSION ELEMENT AND MANUFACTURING METHOD THEREOF
  申请人：JX Nippon Oil & Energy Corporation

  公开号：US20140150868A1

  公开（公告）日：2014-06-05

  A photoelectric conversion element comprising: a photoelectric conversion layer; an electron extraction electrode; a hole extraction electrode; and an electron transport layer, wherein the electron transport layer contains a substance represented by the following chemical formula and a reactant thereof: M(X) a (1) wherein M is selected from the group consisting of alkali metals, alkaline earth metals, group 2B and 3B metals, and transition metals; X is selected from a halogen, a carboxylate group, an alkoxy group, an alkyl group, and an acetonate group represented by the following formula; and a is a positive integer determined in accordance with the valence of M: wherein R 1 and R 2 are selected from hydrogen, a C 1-20 linear or branched alkyl group, and a C 1-20 linear or branched alkoxy group, and R 1 and R 2 may or may not be the same as each other.