1,1'-bis(phenylamino)ferrocene | 343781-35-1

• 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: 1,1'-bis(phenylamino)ferrocene
• 英文别名: dianilinoferrocene；N-cyclopenta-1,3-dien-1-ylaniline;iron(2+)
• CAS: 343781-35-1
• 化学式: C₂₂H₂₀FeN₂
• 分子量: 368.261
• InChiKey: FRVDZDWMRXZBRC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  24.1
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (ferrocenyl)dibromoborane 、 1,1'-bis(phenylamino)ferrocene 在 butyl lithium 作用下， 以 正己烷 为溶剂， 以85%的产率得到1,3-diphenyl-2-ferrocenyl-1,3,2-diazabora-[3]ferrocenophane
  参考文献：
  名称：

  1,3-二苯基-2-二茂铁基-1,3,2-二氮杂硼-[3]二茂铁的合成及晶体结构

  摘要：

  1,1'-双(苯基氨基)二茂铁与二溴(二茂铁基)硼烷反应生成[3]二茂铁。给出了实验细节以及产物的晶体结构。

  DOI：

  10.1515/znb-2008-0718
• 作为产物：
  描述：

  1,1'-di[(N-acetyl-N-phenyl)amido]ferrocene 在 氢氧化钾 作用下， 以 乙醇 为溶剂， 以73%的产率得到1,1'-bis(phenylamino)ferrocene
  参考文献：
  名称：

  Siemeling; Auch; Kuhnert, Zeitschrift fur Anorganische und Allgemeine Chemie, 2003, vol. 629, # 7-8, p. 1334 - 1336

  摘要：

  DOI：

文献信息

• Zirconium Chelates of a Bulky Ferrocene-Based Diamido Ligand
  作者：Ulrich Siemeling、Tanja-Corinna Auch、Sabine Tomm、Heinrich Fink、Clemens Bruhn、Beate Neumann、Hans-Georg Stammler

  DOI：10.1021/om061063e

  日期：2007.2.1

  The arylamino-substituted ferrocene derivative Fe[C5H4(NH-2,4,6-iPr3-C6H2)]2} (1b) reacts with Zr(CH2Ph)4 and Zr(NMe2)4 to afford the respective zirconium chelates [(PhCH2)2ZrFe[C5H4(N-2,4,6-iPr3-C6H2)]2}] (2) and [(Me2N)2ZrFe[C5H4(N-iPr3-2,4,6-C6H2)]2}] (3), which exhibit unexpectedly low catalytic activity in the polymerization of ethylene after activation with MAO and [Ph3C][B(C6F5)4], respectively

  芳基氨基取代的二茂铁衍生物Fe [C 5 H 4（NH-2,4,6- i Pr 3 -C 6 H 2）] 2 }（1b）与Zr（CH 2 Ph）4和Zr（NMe 2）4得到相应的锆螯合物[（PhCH 2）2 Zr Fe [C 5 H 4（N-2,4,6- i Pr 3 -C 6 H 2）] 2 }]（2）和[ （我2 N）2Zr Fe [C 5 H 4（N- i Pr 3 -2,4,6-C 6 H 2）] 2 }]（3），在用MAO和MAO活化后，在乙烯的聚合反应中表现出出乎意料的低催化活性。分别是[Ph 3 C] [B（C 6 F 5）4 ]。为了阐明庞大的芳基取代基的立体电子效应，已经确定了2和3及其母体二茂铁衍生物1b的结构以及苯氨基类似物Fe [C 5 H 4（NHPh）] 2 }（1a），为此已经开发了改进的合成方法。
• Polymerization catalyst
  申请人：Basell Polyolefine GmbH

  公开号：US06743932B2

  公开（公告）日：2004-06-01

  An organometallic compound of the formula I where M1 is selected from among Fe, Ru and Os and M2 is selected from among the transition metals of groups IV to VI of the Periodic Table, which can be prepared by reacting an organometallic compound of the formula II with a transition metal compound of the formula III, M2L1L2(L3)x+1  III where the variables are as defined above and the organometallic compound of the formula II can, if desired, be doubly deproteinated beforehand, can be used as part of a catalyst system for the polymerization or copolymerization of olefins. This catalyst system comprises one or more organometallic compounds of the formula I and at least one activator. The compound of the formula I can also be used to produce a solid catalyst comprising at least one organometallic compound of the formula I, at least one activator and a solid support by impregnating a support material with one or more organometallic compounds of the formula I and at least one activator. This solid catalyst can be used in a process for the polymerization or copolymerization of olefins in bulk, in suspension or in the gas phase.

  化学式为I的有机金属化合物，其中M1从Fe、Ru和Os中选择，M2从周期表IV至VI族过渡金属中选择，可以通过将化学式为II的有机金属化合物与化学式为III的过渡金属化合物反应制备而成，M2L1L2(L3)x+1  III中的变量如上所定义，如果需要，化学式为II的有机金属化合物可以被双重去质子化，可以作为催化剂体系的一部分用于烯烃的聚合或共聚合。该催化剂体系包括一个或多个化学式为I的有机金属化合物和至少一个活化剂。化学式为I的化合物还可以用于生产固体催化剂，该固体催化剂包括至少一个化学式为I的有机金属化合物、至少一个活化剂和固体支撑体，通过将一种或多种化学式为I的有机金属化合物和至少一个活化剂浸渍到支撑材料中制备而成。该固体催化剂可以用于在体积、悬浮或气相中聚合或共聚合烯烃的过程中。
• First Examples of a New Family of Redox-Functionalised Chelate Complexes Based on a 1,1′-Ferrocenediyl-Bridged Di(amido) Ligand
  作者：Ulrich Siemeling、Oliver Kuhnert、Beate Neumann、Anja Stammler、Hans-Georg Stammler、Benno Bildstein、Michael Malaun、Piero Zanello

  DOI：10.1002/1099-0682(200104)2001:4<913::aid-ejic913>3.0.co;2-z

  日期：2001.4
• Alkyl Complexes of Rare-Earth Metal Centers Supported by Chelating 1,1′-Diamidoferrocene Ligands: Synthesis, Structure, and Application in Methacrylate Polymerization
  作者：Jörg Eppinger、Katharina R. Nikolaides、Mei Zhang-Presse、Florian A. Riederer、Gerd W. Rabe、Arnold L. Rheingold

  DOI：10.1021/om700988n

  日期：2008.2.1

  Conversion of 1,1'-dianilinoferrocenes of the composition [3,4-R2C5H2(NHPh)](2)Fe (R = H, Ph) with 1 equiv of the rare-earth metal alkyl precursors Ln(THF)(2)(CH2SiMe3)(3) (Ln = Lu, Y) affords [R(4)Fc(NPh)(2)]Ln(THF)(2)CH2SiMe3 (1a-2b) in yields of 73-83%. The steric bulk of the ferrocene moiety induces a pronounced stabilization of the complexes in comparison to alkyl-bridged analogues. Correspondingly, the complexes 1a-2b are stable in solution at room temperature and were characterized by multinuclear NMR spectroscopy and elemental analysis. A single-crystal X-ray diffraction study was performed for complex 2b. The synthesized rare-earth metal alkyls embedded into a 1,1'-diamidoferrocene framework effectively initiate the polymerization of methyl methacrylate (MMA) at room temperature, producing isotactic enriched poly(methyl methacrylate) (PMMA). The properties of the produced PMMAs are mainly governed by the substitution patterns of the ferrocenyl backbone.