(2,3,9,10,16,17,23,24-octahydroxyphthalocyaninato)zinc(II) | 121322-70-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: (2,3,9,10,16,17,23,24-octahydroxyphthalocyaninato)zinc(II)
• 英文别名: zinc phthalocyanin-2,3,9,10,16,17,23,24-octaol；(2,3,9,10,16,17,23,24-octahydroxylphthalocyaninato) zinc^II；zinc 2,3,9,10,16,17,23,24-octahydroxyphthalocyanine；[(HO)8PcZn]；Zn (2,3,9,10,16,17,23,24)-octahydroxyphthalocyanine；(SP-4-1)-[29H,31H-Phthalocyanine-2,3,9,10,16,17,23,24-octolato(2-)-|EN29,|EN30,|EN31,|EN32]zinc；zinc;2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene-6,7,15,16,24,25,33,34-octol
• CAS: 121322-70-1
• 化学式: C₃₂H₁₆N₈O₈Zn
• 分子量: 705.918
• InChiKey: YBJZYGOSXOOPGP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.77
• 重原子数：
  49
• 可旋转键数：
  0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  238
• 氢给体数：
  8
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  (2,3,9,10,16,17,23,24-octahydroxyphthalocyaninato)zinc(II) 、 芘-2,7-二硼酸 以 1,4-二氧六环 、 甲醇 为溶剂， 生成
  参考文献：
  名称：

  高度取向的2D酞菁共价有机骨架膜的晶格扩展

  摘要：

  扩展应用：共价有机骨架（COF）膜非常适合垂直电荷传输，并用作有序异质结的前体。但是，它们的孔以前很小，无法容纳互补电子受体的连续网络。现在介绍了四种孔尺寸增加到中孔状态的酞菁COF（参见图片）。

  DOI：

  10.1002/anie.201107070
• 作为产物：
  描述：

  zinc 2,3,9,10,16,17,23,24-tetra(isopropylidenedioxy)phthalocyanine 在 硫酸 作用下， 以 硫酸 为溶剂， 以94%的产率得到(2,3,9,10,16,17,23,24-octahydroxyphthalocyaninato)zinc(II)
  参考文献：
  名称：

  摘要：

  A series of new metal monophthalocyanine complexes were synthesized from 4,5-iso-propylidenedioxyphthalonitrile and their spectroscopic and electrochemical properties were studied. The removal of the protective isopropylidene groups from these compounds afforded symmetrically substituted octahydroxyphthalocyanines.

  DOI：

  10.1023/a:1025693009575

文献信息

• Highly stable dioxin-linked metallophthalocyanine covalent organic frameworks
  作者：Zepeng Lei、Francisco W.S. Lucas、Enrique Canales Moya、Shaofeng Huang、Yicheng Rong、Aaron Wesche、Patrick Li、Lauren Bodkin、Yinghua Jin、Adam Holewinski、Wei Zhang

  DOI：10.1016/j.cclet.2021.04.047

  日期：2021.12

  oxidizing (30% H2O2) or reducing agents (1 mol/L NaBH4) for three days due to their stable M-Pc building blocks and resilient dioxin linkers. With metallated phthalocyanine active sites regularly arranged in the stable framework structures, MPc-dx-COFs can be directly used as efficient electrocatalysts for the oxygen reduction reaction (ORR) without pyrolysis treatment that has commonly been used in previous

  我们报告了一系列通过亲核芳香取代（S构成健壮二恶英键连接高度稳定的基于金属酞菁共价有机骨架（MPC-DX-COF的）的Ñ AR）反应。即使在用沸水（90°C），浓酸（12 mol / L HCl）或碱（12 mol / L NaOH）处理，氧化（30％H 2 O 2）处理后，COF的化学结构和结晶度也基本保持不变。）或还原剂（1 mol / L NaBH 4），因为它们具有稳定的M-Pc构建基块和有弹性的二恶英连接子，因此可以使用三天。通过将金属化的酞菁活性位点规则排列在稳定的骨架结构中，MPC-dx-COFs可以直接用作氧还原反应（ORR）的有效电催化剂，而无需进行以往研究中普遍采用的热解处理。
• Two-dimensional conductive metal–organic frameworks with dual metal sites toward the electrochemical oxygen evolution reaction
  作者：Jiawen Li、Peng Liu、Jianxin Mao、Jianyue Yan、Wenbo Song

  DOI：10.1039/d0ta10870g

  日期：——

  Conductive metal–organic frameworks (MOFs) are relevant as active materials for many applications, including electrocatalysis, chemiresistive sensing, and energy storage. However, the structure–activity relationship toward electrocatalysis in conductive MOFs needs to be further explored. Herein, a new strategy of electronic structure modification is proposed by introducing phthalocyanine with extra

  导电金属有机框架（MOF）作为活性材料在许多应用中都具有重要意义，包括电催化，化学感应和能量存储。但是，导电MOF中与电催化的结构活性关系需要进一步探讨。在此，提出了通过将具有额外金属位点的酞菁引入导电MOF中的电子结构改性的新策略。密度泛函理论（DFT）的计算表明，这些MOF具有出色的电导率，且带隙较窄。电化学测试和d带中心计算证实了MOF中NiPc–Ni的最高活性，表明Ni–N 4和Ni–O 4站点对于OER是活跃的。此外，PDOS分析和TOF计算表明Ni–O 4和Ni–N 4位点之间的电子结构相互作用提高了其固有的OER活性。这项工作提供了一种有效的策略，用于调节电子结构并揭示2D导电MOF对电催化的结构-活性关系。
• A Zinc Phthalocyanine Based Periodic Mesoporous Organosilica Exhibiting Charge Transfer to Fullerenes
  作者：Florian Auras、Yan Li、Florian Löbermann、Markus Döblinger、Jörg Schuster、Laurence M. Peter、Dirk Trauner、Thomas Bein

  DOI：10.1002/chem.201404169

  日期：2014.11.10

  Periodic mesoporous organosilica (PMO) materials offer a strategy to position molecular semiconductors within a highly defined, porous network. We developed thin films of a new semiconducting zinc phthalocyanine‐bridged PMO exhibiting a face‐centered orthorhombic pore structure with an average pore diameter of 11 nm. The exceptional degree of order achieved with this PMO enabled us to create thin films

  周期性的介孔有机硅（PMO）材料提供了一种在高度定义的多孔网络内定位分子半导体的策略。我们开发了一种新型的半导体酞菁锌桥联的PMO薄膜，该薄膜表现出以面心为中心的正交晶孔结构，平均孔径为11 nm。用这种PMO达到了非凡的有序度，使我们能够制造出在整个厚度范围内都由单个多孔区域组成的薄膜，从而为随后引入互补相提供了最大的可及性。发现孔壁内的酞菁结构单元聚集良好，可实现电子导电性，并将光收集能力扩展到近红外区域。通过用富勒烯衍生物浸渍PMO，可以构建能够促进光致电荷转移的有序3D异质结。当渗透的PMO集成到光伏设备中时，它能够产生高的开路电压和相当大的光电流，这代表了PMO在光电领域的潜在应用迈出了重要的一步。
• Conducting metallophthalocyanine 2D covalent organic frameworks: the role of central metals in controlling π-electronic functions
  作者：Xuesong Ding、Xiao Feng、Akinori Saeki、Shu Seki、Atsushi Nagai、Donglin Jiang

  DOI：10.1039/c2cc33929c

  日期：——

  Phthalocyanine covalent organic frameworks with different central metals are synthesized, and the AA-stacking structure of the 2D polymer sheets results in periodic phthalocyanine pi-columns. The central metals control the pi-electronic functions, including the improvement of light absorbance, the ease of carrier transport, and the photocurrent gain.

  具有不同中心金属的酞菁共价有机骨架被合成，并在周期性酞菁的π列二维聚合物片结果的AA-堆叠结构。中心金属控制π电子功能，包括提高光吸收率，简化载流子传输和增加光电流。
• Efficient green procedures for the preparation of novel tetraalkynyl-substituted phthalocyanines
  作者：Tamer Ezzat Youssef

  DOI：10.1016/j.poly.2010.02.034

  日期：2010.5

  This work provides a successful, easy and efficient process for the preparation of metal-free 2(3),9(10),16(17),23(24)-octamethoxyphthalocyanine, [(OMe)(8)PcH2] (2), and its metal complexes [(OMe)(8)PcM] (3-11) (M = Zn, Cu, Ni, Mg, Co, Fe, Ru, TiCl and RhCl) by using green energy techniques such as exposure to UV-irradiation as well as microwave irradiation. Two different routes have been used, which involve modifications to that reported in the literature. The results suggest that these techniques drastically reduce the reaction time of metallophthalocyanine [(OMe)(8)PcM] (3-11) formation from 5-96 h to 5-11 min. The prepared octamethoxyphthalocyanines [OMe)(8)PcM] (2-4) (M Zn, Cu) are used as key materials to synthesize the corresponding novel tetraalkynyl-substituted phthalocyanines 15-17. (C) 2010 Elsevier Ltd. All rights reserved.