17,38,59-Tri(pentadecan-8-yl)-3,10,17,24,31,38,45,52,59-nonazanonadecacyclo[55.6.2.212,15.233,36.02,52.04,51.06,49.07,27.09,25.010,23.013,22.014,19.028,48.030,46.031,44.034,43.035,40.054,64.061,65]nonahexaconta-1(64),2,4(51),5,7,9(25),12(69),13(22),14(19),15(68),20,23,26,28,30(46),33(67),34(43),35(40),36(66),41,44,47,49,54,56,61(65),62-heptacosaene-11,16,18,32,37,39,53,58,60-nonone | 1350518-29-4

• 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: 17,38,59-Tri(pentadecan-8-yl)-3,10,17,24,31,38,45,52,59-nonazanonadecacyclo[55.6.2.212,15.233,36.02,52.04,51.06,49.07,27.09,25.010,23.013,22.014,19.028,48.030,46.031,44.034,43.035,40.054,64.061,65]nonahexaconta-1(64),2,4(51),5,7,9(25),12(69),13(22),14(19),15(68),20,23,26,28,30(46),33(67),34(43),35(40),36(66),41,44,47,49,54,56,61(65),62-heptacosaene-11,16,18,32,37,39,53,58,60-nonone
• 英文别名: 17,38,59-tri(pentadecan-8-yl)-3,10,17,24,31,38,45,52,59-nonazanonadecacyclo[55.6.2.212,15.233,36.02,52.04,51.06,49.07,27.09,25.010,23.013,22.014,19.028,48.030,46.031,44.034,43.035,40.054,64.061,65]nonahexaconta-1(64),2,4(51),5,7,9(25),12(69),13(22),14(19),15(68),20,23,26,28,30(46),33(67),34(43),35(40),36(66),41,44,47,49,54,56,61(65),62-heptacosaene-11,16,18,32,37,39,53,58,60-nonone
• CAS: 1350518-29-4
• 化学式: C₁₀₅H₁₁₁N₉O₉
• 分子量: 1643.09
• InChiKey: FSEYUPMZQOBEST-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  29.4
• 重原子数：
  123
• 可旋转键数：
  39
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  217
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  三亚苯-2,3,6,7,10,11-六胺 、 N-(1-heptyloctyl)-naphthalene-3,4,7,8-tetraboxylic-3,4-anhydride-7,8-imide 在 zinc diacetate 作用下， 以 喹啉 为溶剂， 生成 17,38,59-Tri(pentadecan-8-yl)-3,10,17,24,31,38,45,52,59-nonazanonadecacyclo[55.6.2.212,15.233,36.02,52.04,51.06,49.07,27.09,25.010,23.013,22.014,19.028,48.030,46.031,44.034,43.035,40.054,64.061,65]nonahexaconta-1(64),2,4(51),5,7,9(25),12(69),13(22),14(19),15(68),20,23,26,28,30(46),33(67),34(43),35(40),36(66),41,44,47,49,54,56,61(65),62-heptacosaene-11,16,18,32,37,39,53,58,60-nonone
  参考文献：
  名称：

  Charge Transport Anisotropy in n-Type Disk-Shaped Triphenylene-Tris(aroyleneimidazole)s

  摘要：

  Two novel n-type disk-shaped molecules containing a triphenylene core and three fused naphthaleneimide imidazole or peryleneimide imidazole "arms" are synthesized and characterized. The n-type charge carrier mobilities of these molecules are evaluated by both field effect transistors and space-charge limited-current measurements, which exhibit drastically different mobility anisotropy. A strong correlation between film morphology and the charge transport behavior is established by X-ray scattering and atomic force microscopic analyses.

  DOI：

  10.1021/ol202814y

文献信息

• Charge Transport Anisotropy in <i>n</i>-Type Disk-Shaped Triphenylene-Tris(aroyleneimidazole)s
  作者：Yue Zhang、David Hanifi、Steven Alvarez、Francisco Antonio、Andrew Pun、Liana M. Klivansky、Alexander Hexemer、Biwu Ma、Yi Liu

  DOI：10.1021/ol202814y

  日期：2011.12.16

  Two novel n-type disk-shaped molecules containing a triphenylene core and three fused naphthaleneimide imidazole or peryleneimide imidazole "arms" are synthesized and characterized. The n-type charge carrier mobilities of these molecules are evaluated by both field effect transistors and space-charge limited-current measurements, which exhibit drastically different mobility anisotropy. A strong correlation between film morphology and the charge transport behavior is established by X-ray scattering and atomic force microscopic analyses.