2-chloro-2,4,4,6,6-pentaphenoxycyclotriphosphazene | 5032-39-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-chloro-2,4,4,6,6-pentaphenoxycyclotriphosphazene
• 英文别名: monochloropentaphenoxycyclotriphosphazene；2,2,4,4,6-pentaphenoxy-6-chlorocyclotriphosphazene；Chlor-pentaphenoxy-cyclotriphosphazatrien；(2R)-2-chloro-2,4,4,6,6-pentaphenoxy-1,3,5-triaza-2λ5,4λ5,6λ5-triphosphacyclohexa-1,3,5-triene
• CAS: 5032-39-3
• 化学式: C₃₀H₂₅ClN₃O₅P₃
• 分子量: 635.92
• InChiKey: SKMRCNFUSARNRP-UHFFFAOYSA-N

物化性质

• 熔点：
  69-71 °C
• 密度：
  1.38±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  42
• 可旋转键数：
  10
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  83.2
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  2-chloro-2,4,4,6,6-pentaphenoxycyclotriphosphazene 在 sodium azide 、 四丁基溴化铵 作用下， 以 丁酮 为溶剂， 反应 18.0h， 以90%的产率得到N3P3(OC6H5)5(N3)
  参考文献：
  名称：

  Synthesis and Reactivity of Alkoxy, Aryloxy, and Dialkylamino Phosphazene Azides

  摘要：

  DOI：

  10.1021/ja983424q
• 作为产物：
  描述：

  sodium phenoxide 在 六氯环三磷腈 作用下， 生成 2-chloro-2,4,4,6,6-pentaphenoxycyclotriphosphazene
  参考文献：
  名称：

  Dez, Isabelle; Pemberton, Lydie; Jaeger, Roger de, Phosphorus, Sulfur and Silicon and the Related Elements, 1996, vol. 111, p. 34

  摘要：

  DOI：

文献信息

• Excited States of Ru(II) and Re(I) Bipyridyl Complexes Attached to Cyclotriphosphazenes: A Synthetic, Spectroscopic, and Computational Study
  作者：Raphael Horvath、Carl A. Otter、Keith C. Gordon、Andrew M. Brodie、Eric W. Ainscough

  DOI：10.1021/ic902171j

  日期：2010.5.3

  cyclotriphosphazene ligands substituted with pendant 2,2′-bipyridyl moieties, namely, bis[(1,1′-biphenyl)-2,2′-dioxy](2,2′-bipyridyl-3,3′-dioxy)cyclotriphosphazene (L1), bis[(1,1′-biphenyl)-2,2′-dioxy][bis4-(2,2′-bipyridin)-4-yl-phenyoxy}]cyclotriphosphazene (L2), (pentaphenoxy)[4-(2,2′-bipyridin)-4-yl-phenyoxy]cyclotriphosphazene (L3), and (pentaphenoxy) [4-6-phenyl(2,2′-bipyridin)-4-yl}-phenoxy]cyclotriphosphazene

  一系列新的环三磷腈配体被侧链的2,2'-联吡啶基部分取代，即双[（1,1'-联苯）-2,2'-二氧基]（2,2'-联吡啶-3,3'-二氧]环三磷腈（L 1），双[（1,1'-联苯）-2,2'-二氧] [双4-（2,2'-联吡啶）-4-基-苯氧基}]环三磷腈（L 2），（五苯氧基）[4-（2,2'-联吡啶）-4-基-苯氧基]环三磷腈（L 3）和（五苯氧基）[4- 6-苯基（2,2'-联吡啶））-已使用4-yl}-苯氧基]环三磷腈（L 4）合成钌（II）和rh（I）配合物[（L）Ru（bpy）2 ]（PF 6）4（L = L 1或L 3），[（L 2）Ru（bpy）2} 2 ]（PF 6）4，[（L）Re（CO）3 Cl]（L = L 1，L 3或L 4）和[（L 2）Re（CO）3 Cl} 2 ]。[（L 1）Re（CO）3 Cl]和[（L 4）Re（CO）3 Cl]的单晶X射线结构
• Process For Producing Phosphonitrilic Acid Ester
  申请人：Kuwata Kotaro

  公开号：US20080091050A1

  公开（公告）日：2008-04-17

  A process for producing a cyclic and/or linear phosphonitrilic acid ester from a cyclic and/or linear phosphonitrile dichloride is provided, wherein the reaction time is shorter and the content of monochloro phosphazenes is very small. When phosphonitrile dichloride is reacted with a metal arylolate and/or a metal alcoholate in the presence of a reaction solvent, a metal arylolate and/or a metal alcoholate composed of at least two different metals having different ionization energies is used and also a specific compound is used as a catalyst.

  解决的问题：提供一种从环状和/或线性磷酸腈二氯化物制备环状和/或线性磷氮酸酯的方法，其中反应时间较短，单氯磷氮烷的含量非常小。 解决方案：当磷酸腈二氯化物与金属芳酚醇盐和/或金属醇盐在反应溶剂存在下反应时，使用由至少两种具有不同电离能的金属组成的金属芳酚醇盐和/或金属醇盐，并且还使用特定化合物作为催化剂。
• Determination of31P,31P coupling constants in cyclotriphosphazenes and their influence on1H and13C NMR spectra of phosphorus substituents
  作者：Virginie Vicente、Alain Fruchier、Henri-Jean Cristau

  DOI：10.1002/mrc.1155

  日期：2003.3

  1H and 13C NMR spectra of symmetrically substituted cyclotriphosphazenes exhibit second-order effects. The influence of the 31P,31P coupling constants between ring phosphorus atoms on these effects was studied. Some values of this coupling constant between phosphorus bearing identical substituents were measured using 13C satellites of the 31P signals or by introduction of a chiral substituent on the third phosphorus atom. Copyright © 2003 John Wiley & Sons, Ltd.

  对称取代的环三唑膦的 1H 和 13C NMR 光谱显示出二阶效应。我们研究了环状磷原子之间的 31P,31P 耦合常数对这些效应的影响。利用 31P 信号的 13C 卫星或在第三个磷原子上引入手性取代基，测量了具有相同取代基的磷之间的耦合常数的一些值。Copyright © 2003 John Wiley & Sons, Ltd. All Rights Reserved.
• Phosphorus–nitrogen compounds. Part XXIV. Studies on the alcoholysis and hydrolysis of geminal phenylchlorocyclotriphosphazatrienes. Some “cyclotriphosphazadienes” and a “cyclotriphosphazene”
  作者：B. W. Fitzsimmons、C. Hewlett、K. Hills、R. A. Shaw

  DOI：10.1039/j19670000679

  日期：——

  The reactions of some geminal phenylchlorocyclotriphosphazatrienes, N3P3Ph2Cl4 and N3P3Ph4Cl2, with alkoxide ions have been investigated. The expected geminal alkoxy-derivatives, N3P3Ph2(OR)4 and N3P3Ph4(OR)2, have been isolated together with variable yields of by-products in which one alkoxy-group of the alkoxyphenylcyclo-triphosphazatriene has been replaced by the elements of a hydroxy group to yield

  研究了一些双键的苯基氯环三磷氮杂蒽，N 3 P 3 Ph 2 Cl 4和N 3 P 3 Ph 4 Cl 2与醇盐离子的反应。预期的宝石烷氧基衍生物N 3 P 3 Ph 2（OR）4和N 3 P 3 Ph 4（OR）2分离了具有可调节产率的副产物，其中副产物中的烷氧基苯基环三磷氮杂三烯的一个烷氧基被羟基的元素取代，从而产生“环三磷氮杂二烯”。用无水氯化氢对双乙二氧基四苯基-和六甲氧基-环三磷氮杂三烯的处理分别导致了“环三磷氮杂二烯”和“环三磷氮杂”。通过用碘化钠在丙酮中处理，将2,4,6-三苄氧基-1,3,5-三苄基-2,4,6-三氧代环三磷氮烷进行O-脱苄基作用。建议这些“水解”产品的结构以其红外和1的证据为依据。讨论了氢核磁共振谱及其形成方式，并与氯和烷氧基磷腈的水解产物进行了比较。
• A new cyclotriphosphazene appended phenanthroline derivative as a highly selective and sensitive OFF–ON fluorescent chemosensor for Al 3+ ions
  作者：Emrah Özcan、Süreyya O. Tümay、Hüsnüye Ardıç Alidağı、Bünyemin Çoşut、Serkan Yeşilot

  DOI：10.1016/j.dyepig.2016.05.006

  日期：2016.9

  A new type of fluorescent chemosensor based on a novel cyclotriphosphazene appended phenanthroline derivative was synthesized and its sensing behavior toward metal ions was investigated by UV/vis and fluorescence spectroscopies. Addition of an Al3+ ion to an acetonitrile solution of the phenanthroline derivative exhibited a significant increase of fluorescence emission intensities, while 18 other metal

  合成了一种新型的基于新型环三磷腈附加菲咯啉衍生物的荧光化学传感器，并通过紫外/可见光谱和荧光光谱研究了其对金属离子的传感行为。在菲咯啉衍生物的乙腈溶液中添加Al 3+离子后，荧光发射强度显着增加，而其他18种金属离子未引起光谱变化。发现该菲咯啉衍生物作为Al 3+的OFF-ON荧光化学传感器的候选者，具有高选择性和灵敏性，并且检测限低（1.825μgL -1）。