9,10-Bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-3,6-dibromophenanthrene | 1346783-16-1

• 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: 9,10-Bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-3,6-dibromophenanthrene
• CAS: 1346783-16-1
• 化学式: C₅₆H₄₄Br₂O₆
• 分子量: 972.77
• InChiKey: NRHHAUJDSSBQLK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.6
• 重原子数：
  64
• 可旋转键数：
  18
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  55.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  9,10-Bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-3,6-dibromophenanthrene 、 三甲基乙炔基硅 在 copper(l) iodide 、 四(三苯基膦)钯 、 二乙胺 作用下， 以 四氢呋喃 为溶剂， 反应 24.0h， 以90%的产率得到((9,10-bis((3,5-bis(benzyloxy)benzyl)oxy)phenanthrene-3,6-diyl)bis(ethyne-2,1-diyl))bis(trimethylsilane)
  参考文献：
  名称：

  Synthesis and characterization of dendritic platinum bisferrocenylacetylide complexes

  摘要：

  一系列新的树枝状铂双二茂铁基乙炔基化合物已经合成，利用转型铂配合物与炔烃中的C-H键偶联反应作为关键步骤。这些新的双金属树状化合物通过多核NMR（1H、13C和31P）和质谱分析（MALDI-TOF-MS和CSI-TOF-MS）进行了全面表征。对这些化合物的电化学研究表明，所有氧化还原基团都是稳定的、独立的和具有电化学活性的。此外，所有金属树状化合物均显示出单电子反应响应，这些化合物的尺寸增加并未对扩散系数产生显著影响。

  DOI：

  10.1139/v11-159
• 作为产物：
  描述：

  菲醌 在 叔丁基过氧化氢 、 sodium dithionite 、 溴 、 potassium carbonate 作用下， 以 四氢呋喃 、 水 、 硝基苯 、 N,N-二甲基甲酰胺 为溶剂， 反应 25.0h， 生成 9,10-Bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-3,6-dibromophenanthrene
  参考文献：
  名称：

  Design and Synthesis of 60° Dendritic Donor Ligands and Their Coordination-Driven Self-Assembly into Supramolecular Rhomboidal Metallodendrimers

  摘要：

  The design and self-assembly of novel rhomboidal metallodendrimers via coordination-driven self-assembly is described. By employing newly designed 60 degrees ditopic donor linkers substituted with Frechet-type dendrons and appropriate 120 degrees rigid di-Pt(II) acceptor subunits, a variety of [G-1] [G-3] rhomboidal metallodendrimers with well-defined shape and size were prepared under mild conditions in high yields. The supramolecular metalloden-drimers were characterized with multinuclear NMR (H-1 and P-31), mass spectrometry (CSI-TOF-MS), and elemental analysis. Isotopically resolved mass spectrometry data support the existence of the metallodendrimers with rhomboidal cavities, and NMR data were consistent with the formation of all ensembles. The shape and size of all rhomboidal metallodendrimers were investigated with the PM6 semiempirical molecular orbital method.

  DOI：

  10.1021/jo201594u

文献信息

• Synthesis of Triangular Metallodendrimers via Coordination-Driven Self-Assembly
  作者：Qing Han、Li-Lei Wang、Quan-Jie Li、Guang-Zhen Zhao、Jiuming He、Bingjie Hu、Hongwei Tan、Zeper Abliz、Yihua Yu、Hai-Bo Yang

  DOI：10.1021/jo300016a

  日期：2012.4.6

  A new family of 60 degrees dendritic di-Pt(II) acceptor tectons have been successfully designed and synthesized, from which a series of novel "threecomponent" triangular metallodendrimers were prepared via [3 + 3] coordination-driven self-assembly. The structures of newly designed triangular metallodendrimers are characterized by multinuclear NMR (H-1 and P-31), H-1 DOSY NMR, mass spectrometry (CSI-TOF-MS), and elemental analysis. The shape and size of all supramolecular dendritic triangles were investigated with PM6 semiempirical molecular orbital methods.
• Design and Synthesis of 60° Dendritic Donor Ligands and Their Coordination-Driven Self-Assembly into Supramolecular Rhomboidal Metallodendrimers
  作者：Qing Han、Quan-Jie Li、Jiuming He、Bingjie Hu、Hongwei Tan、Zeper Abliz、Cui-Hong Wang、Yihua Yu、Hai-Bo Yang

  DOI：10.1021/jo201594u

  日期：2011.12.2

  The design and self-assembly of novel rhomboidal metallodendrimers via coordination-driven self-assembly is described. By employing newly designed 60 degrees ditopic donor linkers substituted with Frechet-type dendrons and appropriate 120 degrees rigid di-Pt(II) acceptor subunits, a variety of [G-1] [G-3] rhomboidal metallodendrimers with well-defined shape and size were prepared under mild conditions in high yields. The supramolecular metalloden-drimers were characterized with multinuclear NMR (H-1 and P-31), mass spectrometry (CSI-TOF-MS), and elemental analysis. Isotopically resolved mass spectrometry data support the existence of the metallodendrimers with rhomboidal cavities, and NMR data were consistent with the formation of all ensembles. The shape and size of all rhomboidal metallodendrimers were investigated with the PM6 semiempirical molecular orbital method.
• Synthesis and characterization of dendritic platinum bisferrocenylacetylide complexes
  作者：Qing Han、Li-Jun Chen、Hai-Bo Yang、Quan-Jie Li、Jiuming He、Hongwei Tan、Zeper Abliz、Cui-Hong Wang

  DOI：10.1139/v11-159

  日期：2012.3

  A series of new dendritic platinum bisferrocenylacetylide complexes have been synthesized utilizing the coupling reaction of trans-Pt complexes with C–H bonds in alkynes as key steps. These new bimetallic dendrimers were fully characterized by multinuclear NMR (¹H, ¹³C, and ³¹P) and mass spectrometry (MALDI-TOF-MS and CSI-TOF-MS). Electrochemical studies of these complexes were carried out and revealed that all of the redox moieties are stable, independent, and electrochemically active. In addition, all metallodendrimers show one-electron reaction responses, and the increased sizes of these complexes did not exhibit a dramatic influence on the diffusion coefficient.

  一系列新的树枝状铂双二茂铁基乙炔基化合物已经合成，利用转型铂配合物与炔烃中的C-H键偶联反应作为关键步骤。这些新的双金属树状化合物通过多核NMR（1H、13C和31P）和质谱分析（MALDI-TOF-MS和CSI-TOF-MS）进行了全面表征。对这些化合物的电化学研究表明，所有氧化还原基团都是稳定的、独立的和具有电化学活性的。此外，所有金属树状化合物均显示出单电子反应响应，这些化合物的尺寸增加并未对扩散系数产生显著影响。