21-(29-Dodecyl-15,33-dioxo-18,21,36,40-tetraphenoxy-7,14,25,32-tetrazaundecacyclo[21.13.2.22,5.03,19.04,16.06,14.08,13.020,37.024,32.026,31.034,38]tetraconta-1(36),2(40),3,5(39),6,8(13),9,11,16,18,20,22,24,26(31),27,29,34,37-octadecaen-10-yl)-7-(4-tridecan-7-ylphenyl)-7,18,25-triazanonacyclo[14.13.2.22,5.03,12.04,9.013,30.017,25.019,24.027,31]tritriaconta-1(29),2(33),3(12),4(9),5(32),10,13(30),14,16(31),18,20,22,27-tridecaene-6,8,26-trione

• 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: 21-(29-Dodecyl-15,33-dioxo-18,21,36,40-tetraphenoxy-7,14,25,32-tetrazaundecacyclo[21.13.2.22,5.03,19.04,16.06,14.08,13.020,37.024,32.026,31.034,38]tetraconta-1(36),2(40),3,5(39),6,8(13),9,11,16,18,20,22,24,26(31),27,29,34,37-octadecaen-10-yl)-7-(4-tridecan-7-ylphenyl)-7,18,25-triazanonacyclo[14.13.2.22,5.03,12.04,9.013,30.017,25.019,24.027,31]tritriaconta-1(29),2(33),3(12),4(9),5(32),10,13(30),14,16(31),18,20,22,27-tridecaene-6,8,26-trione
• 英文别名: 21-(29-dodecyl-15,33-dioxo-18,21,36,40-tetraphenoxy-7,14,25,32-tetrazaundecacyclo[21.13.2.22,5.03,19.04,16.06,14.08,13.020,37.024,32.026,31.034,38]tetraconta-1(36),2(40),3,5(39),6,8(13),9,11,16,18,20,22,24,26(31),27,29,34,37-octadecaen-10-yl)-7-(4-tridecan-7-ylphenyl)-7,18,25-triazanonacyclo[14.13.2.22,5.03,12.04,9.013,30.017,25.019,24.027,31]tritriaconta-1(29),2(33),3(12),4(9),5(32),10,13(30),14,16(31),18,20,22,27-tridecaene-6,8,26-trione
• 化学式: C₁₂₁H₉₉N₇O₉
• 分子量: 1795.1
• InChiKey: ABNNUQKESHSBCQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  31.7
• 重原子数：
  137
• 可旋转键数：
  32
• 环数：
  25.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  177
• 氢给体数：
  0
• 氢受体数：
  12

文献信息

• LIQUID CRYSTAL DYE MIXTURE
  申请人：Van Oosten Casper Laurens

  公开号：US20140138579A1

  公开（公告）日：2014-05-22

  A guest-host liquid crystal dye mixture comprising a calamatic, thermotropic liquid crystal as host and a dichroic fluorescent dye as guest, characterized in that the dichroic fluorescent dye is a multichromophoric dye containing at least a group with the general formula Ry-X 1 —C 1 , wherein Ry is a chromophore from the rylene family, C 1 is a second chromophore and X 1 is a spacer that interrupts the conjugation between Ry and C 1 , the spacer X 1 is selected such that it introduces rigidity against bending or folding over an axis perpendicular to the length of the molecule.
• US9249356B2
  申请人：——

  公开号：US9249356B2

  公开（公告）日：2016-02-02