1,2,4,5-tetra(dimethoxyphosphorylmethyl)benzene | 156745-65-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机膦酸及其衍生物
• 英文名称: 1,2,4,5-tetra(dimethoxyphosphorylmethyl)benzene
• 英文别名: 1,2,4,5-Tetrakis(dimethoxyphosphorylmethyl)benzene；1,2,4,5-tetrakis(dimethoxyphosphorylmethyl)benzene
• CAS: 156745-65-2
• 化学式: C₁₈H₃₄O₁₂P₄
• 分子量: 566.356
• InChiKey: APWIVMDJQFKQRV-UHFFFAOYSA-N

物化性质

• 熔点：
  185-187 °C
• 沸点：
  661.3±55.0 °C(predicted)
• 密度：
  1.304±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.9
• 重原子数：
  34
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  142
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  1,2,4,5-tetra(dimethoxyphosphorylmethyl)benzene 、 苯并[b]呋喃-2-甲醛 在 potassium tert-butylate 作用下， 以 四氢呋喃 为溶剂， 以57.7%的产率得到1,2,4,5-tetra[2-(benzofuran-2-yl)vinyl]benzene
  参考文献：
  名称：

  Substitution degree engineering the crystal packing and optoelectronic properties of benzofuranvinyl-substituted benzene-cored derivatives

  摘要：

  分子形状对溶解度、多晶形态、晶体排列和光电性能产生显著影响，寻找三维有机半导体。

  DOI：

  10.1039/c4tc00220b
• 作为产物：
  描述：

  四溴甲苯 、 三甲氧基磷 生成 1,2,4,5-tetra(dimethoxyphosphorylmethyl)benzene
  参考文献：
  名称：

  得益于强大的电子耦合，新型双支化有机化合物具有增强的双光子吸收能力

  摘要：

  两种新型的多支有机化合物，1,2,4,5-四[[4'- N，N-二乙基氨基）苯乙烯基]苯（TDEASB）和1,2,4,5-四[[4'- N，N设计并合成了在共轭臂之间具有强电子偶联的-二丁基氨基）苯乙烯基苯（TDBASB）。已经仔细研究了它们的单光子和双光子吸收（TPA）和光致发光（PL）特性。通过使用200 fs，76 MHz，Ti：蓝宝石激光器的双光子激发荧光技术估算了这两种化合物的双光子吸收截面，对于TDEASB和TDBASB而言，它们分别高达810和1030 GM。TPA横截面很强，表明这些苯核基多支化化合物具有出色的共轭和电子离域性能。

  DOI：

  10.1016/j.cplett.2005.08.041

文献信息

• New Class of Phosphine Oxide Donor-Based Supramolecular Coordination Complexes from an in Situ Phosphine Oxidation Reaction or Phosphine Oxide Ligands
  作者：Bhaskaran Shankar、Palani Elumalai、Ramasamy Shanmugam、Virender Singh、Dhanraj T. Masram、Malaichamy Sathiyendiran

  DOI：10.1021/ic401257w

  日期：2013.9.16

  coordination-driven self-assembly approach was used to synthesize the first examples of neutral bridging phosphine oxide donor-based supramolecular coordination complexes. The complexes were self-assembled from a fac-Re(CO)3 acceptor, an anionic bridging O donor, and a neutral soft phosphine or hard phosphine oxide donor.

  单罐，多组件，协调驱动的自组装方法用于合成中性桥接氧化膦供体的超分子配位配合物的第一个例子。该复合物是由fac -Re（CO）3受体，阴离子桥联的O供体和中性的软膦或硬膦氧化物供体自组装而成。
• Synthesis and efficient three-photon excited green fluorescence of pyridine–triphenylamine conjugated dyes
  作者：Ying Qian、Manli Luo

  DOI：10.1016/j.dyepig.2013.10.011

  日期：2014.2

  Pyridine-end-capped triphenylamine derivatives (Py-2-TPA)(n) (n = 1,2,4) were synthesized using palladium-catalyzed Heck reaction and characterized by H-1 NMR, C-13 NMR, and HRMS-MALDI-TOF. Three-photon absorption and three-photon excited fluorescence properties of chromophores (Py-2-TPA)(n) were studied using a femtosecond Ti:Sapphire laser system. These chromophores exhibit efficient three-photon excited green fluorescence peaking at 540-590 nm. The three-photon absorption cros-ssection of sigma(3) = 6.99 x 10(-79) cm(6) s(2) photon(-2) in the femtosecond regime has been obtained from (Py-2-TPA)(4). The ratio of 3PA cross-sections in CH2Cl2 solution sigma(3) (Py-2-TPA)(4):sigma(3) (Py-2-TPA)(2):sigma(3) (Py-2-TPA)(1) is 6.0:4.2:1. The ratio of conjugated Tr-electron numbers in (Py-2-TPA)(n) is 4.4(n = 4):2.6(n = 2):1(n = 1). The increasing the push-pull units of (Py-2-TPA)(n) and pi-electron conjugation length or increasing the extent of charge transfer from the ends to the middle aryl core results in an increase of the 3PA cross-section. The results indicate that large aromatic conjugated chromophores (Py-2-TPA)(n) containing pyridine-tri-phenylamine D-A pairs and a conjugated aryl core provide a new opportunity for 3PA-materials and three-photon fluorophores for practical application. (C) 2013 Elsevier Ltd. All rights reserved.
• Novel multi-branched organic compounds with enhanced two-photon absorption benefiting from the strong electronic coupling
  作者：Yan Ren、Qian Xin、Xu-Tang Tao、Lei Wang、Xiao-Qiang Yu、Jia-Xiang Yang、Min-Hua Jiang

  DOI：10.1016/j.cplett.2005.08.041

  日期：2005.10

  multi-branched organic compounds, 1,2,4,5-tetrakis[(4′-N,N-diethylamino)styryl]benzene (TDEASB) and 1,2,4,5-tetrakis[(4′-N,N-dibutylamino)styryl]benzene (TDBASB), with strong electronic coupling among the conjugated arms, have been designed and synthesized. Their single-photon and two-photon absorption (TPA) and photoluminescent (PL) properties have been studied carefully. The two-photon absorption cross-sections

  两种新型的多支有机化合物，1,2,4,5-四[[4'- N，N-二乙基氨基）苯乙烯基]苯（TDEASB）和1,2,4,5-四[[4'- N，N设计并合成了在共轭臂之间具有强电子偶联的-二丁基氨基）苯乙烯基苯（TDBASB）。已经仔细研究了它们的单光子和双光子吸收（TPA）和光致发光（PL）特性。通过使用200 fs，76 MHz，Ti：蓝宝石激光器的双光子激发荧光技术估算了这两种化合物的双光子吸收截面，对于TDEASB和TDBASB而言，它们分别高达810和1030 GM。TPA横截面很强，表明这些苯核基多支化化合物具有出色的共轭和电子离域性能。
• Substitution degree engineering the crystal packing and optoelectronic properties of benzofuranvinyl-substituted benzene-cored derivatives
  作者：Jin-Xing Qiu、Ye-Xin Li、Xiao-Feng Yang、Yong Nie、Zhen-Wei Zhang、Zhong-He Chen、Guo-Xin Sun

  DOI：10.1039/c4tc00220b

  日期：——

  The molecular shape exerts remarkable effects on solubility, polymorphism, crystal packing and optoelectronic properties – searching for 3D organic semiconductors.

  分子形状对溶解度、多晶形态、晶体排列和光电性能产生显著影响，寻找三维有机半导体。