3,6,7,10,11-penta(hexyloxy)-2-(4-phthalimidobutyloxy)triphenylene | 1260541-52-3

• 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: 3,6,7,10,11-penta(hexyloxy)-2-(4-phthalimidobutyloxy)triphenylene
• 英文别名: 2-[4-(3,6,7,10,11-Pentahexoxytriphenylen-2-yl)oxybutyl]isoindole-1,3-dione；2-[4-(3,6,7,10,11-pentahexoxytriphenylen-2-yl)oxybutyl]isoindole-1,3-dione
• CAS: 1260541-52-3
• 化学式: C₆₀H₈₃NO₈
• 分子量: 946.321
• InChiKey: QZUMYKJUHRVORT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  19.1
• 重原子数：
  69
• 可旋转键数：
  36
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  92.8
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  3,6,7,10,11-penta(hexyloxy)-2-(4-phthalimidobutyloxy)triphenylene 在 一水合肼 作用下， 以 乙醇 、 水 为溶剂， 反应 1.5h， 以86%的产率得到2-(4-aminobutyloxy)-3,6,7,10,11-penta(hexyloxy)triphenylene
  参考文献：
  名称：

  A Mesogenic Triphenylene−Perylene−Triphenylene Triad

  摘要：

  A straightforward synthesis of triphenylene-perylene-triphenylene triad structures has been achieved by using versatile triphenylene intermediates bearing a single oxyalkyl amine side chain. Among these, PBITP10 showed a stable columnar mesophase implying favorably matched core-core separations in the structure. Importantly, the triad can be used as a vehicle for doping columnar triphenylene matrices with functional but incompatible perylene units and a mixture of hexahexyloxytriphenylene matrix doped with 0.1% PBITP10 is homogeneous and liquid crystalline.

  DOI：

  10.1021/ol103018v
• 作为产物：
  描述：

  1,2-二己氧基苯 在 iron(III) chloride 、 硝基甲烷 、 potassium carbonate 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 48.0h， 生成 3,6,7,10,11-penta(hexyloxy)-2-(4-phthalimidobutyloxy)triphenylene
  参考文献：
  名称：

  A Mesogenic Triphenylene−Perylene−Triphenylene Triad

  摘要：

  A straightforward synthesis of triphenylene-perylene-triphenylene triad structures has been achieved by using versatile triphenylene intermediates bearing a single oxyalkyl amine side chain. Among these, PBITP10 showed a stable columnar mesophase implying favorably matched core-core separations in the structure. Importantly, the triad can be used as a vehicle for doping columnar triphenylene matrices with functional but incompatible perylene units and a mixture of hexahexyloxytriphenylene matrix doped with 0.1% PBITP10 is homogeneous and liquid crystalline.

  DOI：

  10.1021/ol103018v

文献信息

• A Mesogenic Triphenylene−Perylene−Triphenylene Triad
  作者：Xiangfei Kong、Zhiqun He、Yinning Zhang、Linping Mu、Chunjun Liang、Bo Chen、Xiping Jing、Andrew N Cammidge

  DOI：10.1021/ol103018v

  日期：2011.2.18

  A straightforward synthesis of triphenylene-perylene-triphenylene triad structures has been achieved by using versatile triphenylene intermediates bearing a single oxyalkyl amine side chain. Among these, PBITP10 showed a stable columnar mesophase implying favorably matched core-core separations in the structure. Importantly, the triad can be used as a vehicle for doping columnar triphenylene matrices with functional but incompatible perylene units and a mixture of hexahexyloxytriphenylene matrix doped with 0.1% PBITP10 is homogeneous and liquid crystalline.