1,2,3,5,6,7-hexakis(hexyloxy)anthracene-9,10-dione

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 1,2,3,5,6,7-hexakis(hexyloxy)anthracene-9,10-dione
• 英文别名: 1,2,3,5,6,7-Hexahexoxyanthracene-9,10-dione；1,2,3,5,6,7-hexahexoxyanthracene-9,10-dione
• 化学式: C₅₀H₈₀O₈
• 分子量: 809.18
• InChiKey: RQQVOSPHEHPCPN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.7
• 重原子数：
  58
• 可旋转键数：
  36
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  89.5
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  1,2,3,5,6,7-hexakis(hexyloxy)anthracene-9,10-dione 在 甲醇 、 sodium tetrahydroborate 作用下， 以 二氯甲烷 为溶剂， 以0.2 g的产率得到1,2,3,5,6,7-hexakis(hexyloxy)anthracene
  参考文献：
  名称：

  Strongly Dichroic Organic Films via Controlled Assembly of Modular Aromatic Charge-Transfer Liquid Crystals

  摘要：

  The formation of highly anisotropic organic thin films based on the designed self-assembly of mixed-stack liquid crystals is reported. A series of alkoxyanthracene donors is combined in a modular fashion with a naphthalenedlimide acceptor to generate new charge-transfer columnar liquid crystals. Materials characterization and molecular modeling provides insight into structure function relationships in these organic materials that lead to the striking bulk dichroic properties of certain molecular assemblies.

  DOI：

  10.1021/acs.orglett.5b02399
• 作为产物：
  描述：

  六羟基蒽醌 在 氢氧化钾 、 sodium hydroxide 作用下， 以 二甲基亚砜 为溶剂， 反应 42.0h， 生成 1,2,3,5,6,7-hexakis(hexyloxy)anthracene-9,10-dione
  参考文献：
  名称：

  Kumar, Sandeep; Naidu, Jaishri J., Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 2002, vol. 378, p. 123 - 128

  摘要：

  DOI：

文献信息

• Strongly Dichroic Organic Films via Controlled Assembly of Modular Aromatic Charge-Transfer Liquid Crystals
  作者：Ariana Gray Bé、Cheryl Tran、Riley Sechrist、Joseph J. Reczek

  DOI：10.1021/acs.orglett.5b02399

  日期：2015.10.2

  The formation of highly anisotropic organic thin films based on the designed self-assembly of mixed-stack liquid crystals is reported. A series of alkoxyanthracene donors is combined in a modular fashion with a naphthalenedlimide acceptor to generate new charge-transfer columnar liquid crystals. Materials characterization and molecular modeling provides insight into structure function relationships in these organic materials that lead to the striking bulk dichroic properties of certain molecular assemblies.
• Kumar, Sandeep; Naidu, Jaishri J., Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 2002, vol. 378, p. 123 - 128
  作者：Kumar, Sandeep、Naidu, Jaishri J.

  DOI：——

  日期：——