18,23,23,36-Tetraoxo-22-oxa-23lambda6-thia-10,17,28,35-tetrazadodecacyclo[24.14.1.14,8.02,24.03,21.05,40.09,17.011,16.027,35.029,34.037,41.019,42]dotetraconta-1(40),2(24),3(21),4,6,8(42),9,11(16),12,14,19,25,27,29(34),30,32,37(41),38-octadecaene-14,32-disulfonic acid | 784179-84-6

• 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: 18,23,23,36-Tetraoxo-22-oxa-23lambda6-thia-10,17,28,35-tetrazadodecacyclo[24.14.1.14,8.02,24.03,21.05,40.09,17.011,16.027,35.029,34.037,41.019,42]dotetraconta-1(40),2(24),3(21),4,6,8(42),9,11(16),12,14,19,25,27,29(34),30,32,37(41),38-octadecaene-14,32-disulfonic acid
• 英文别名: 18,23,23,36-tetraoxo-22-oxa-23λ6-thia-10,17,28,35-tetrazadodecacyclo[24.14.1.14,8.02,24.03,21.05,40.09,17.011,16.027,35.029,34.037,41.019,42]dotetraconta-1(40),2(24),3(21),4,6,8(42),9,11(16),12,14,19,25,27,29(34),30,32,37(41),38-octadecaene-14,32-disulfonic acid
• CAS: 784179-84-6
• 化学式: C₃₆H₁₄N₄O₁₁S₃
• 分子量: 774.725
• InChiKey: HVIIRHMUMCYHJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  54
• 可旋转键数：
  2
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  247
• 氢给体数：
  2
• 氢受体数：
  13

反应信息

• 作为产物：
  描述：

  3,4-二氨基苯磺酸 、 PTCADA monosultone 以 溶剂黄146 为溶剂， 反应 8.0h， 生成 18,23,23,27-Tetraoxo-22-oxa-23lambda6-thia-10,17,28,35-tetrazadodecacyclo[24.14.1.14,8.02,24.03,21.05,40.09,17.011,16.028,36.029,34.037,41.019,42]dotetraconta-1(40),2(24),3(21),4,6,8(42),9,11(16),12,14,19,25,29(34),30,32,35,37(41),38-octadecaene-14,31-disulfonic acid 、 18,23,23,36-Tetraoxo-22-oxa-23lambda6-thia-10,17,28,35-tetrazadodecacyclo[24.14.1.14,8.02,24.03,21.05,40.09,17.011,16.027,35.029,34.037,41.019,42]dotetraconta-1(40),2(24),3(21),4,6,8(42),9,11(16),12,14,19,25,27,29(34),30,32,37(41),38-octadecaene-14,32-disulfonic acid
  参考文献：
  名称：

  Lyotropic liquid crystal systems based on perylenetetracarboxylic acid dibenzimidazole sulfoderivatives, related anisotropic films, and methods for making

  摘要：

  提供了酞菁四羧酸二苯并咪唑磺衍生物。这些化合物形成的液晶体系具有优良的光学性能。所得到的液晶体系很容易涂覆在基材上，以获得在各个领域应用的光学各向同性或各向异性，至少部分结晶的薄膜。

  公开号：

  US20040215015A1

文献信息

• US7160485B2
  申请人：——

  公开号：US7160485B2

  公开（公告）日：2007-01-09
• Lyotropic liquid crystal systems based on perylenetetracarboxylic acid dibenzimidazole sulfoderivatives, related anisotropic films, and methods for making
  申请人：——

  公开号：US20040215015A1

  公开（公告）日：2004-10-28

  Sulfoderivatives of perylenetetracarboxylic acid dibenzimidazole are provided. These compounds form liquid crystal systems possessing high quality optical properties. The resulting liquid crystal systems are readily applicable onto a substrate to obtain optically isotropic or anisotropic, at least partially crystalline films applicable in various fields.

  提供了酞菁四羧酸二苯并咪唑磺衍生物。这些化合物形成的液晶体系具有优良的光学性能。所得到的液晶体系很容易涂覆在基材上，以获得在各个领域应用的光学各向同性或各向异性，至少部分结晶的薄膜。