1,3-bis(5,5'-di-tert-butyl-2,2'-dihydroxydiphenylmethyl)benzene

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: 1,3-bis(5,5'-di-tert-butyl-2,2'-dihydroxydiphenylmethyl)benzene
• 英文别名: 4,4',4",4'"-tetra-t-butyl-2,2',2",2'"-(phenylenemethanediyl)tetraphenol；2-[[3-[Bis(5-tert-butyl-2-hydroxyphenyl)methyl]phenyl]-(5-tert-butyl-2-hydroxyphenyl)methyl]-4-tert-butylphenol
• 化学式: C₄₈H₅₈O₄
• 分子量: 698.986
• InChiKey: ZGDJZTGUACMIJR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.9
• 重原子数：
  52
• 可旋转键数：
  10
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  80.9
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1,3-bis(5,5'-di-tert-butyl-2,2'-dihydroxydiphenylmethyl)benzene 在 三乙胺 、 三氯化磷 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Tetraphenol-based diphosphite ligands: synthesis, characterization, and application in the rhodium-catalyzed hydroformylation of octenes

  摘要：

  A new class of diphosphites is described, based on a tetraphenol backbone. Ligands TP1-TP5 were synthesized and fully characterized and their application in the hydroformylation of octenes was investigated. Ligand TP3, bearing a 1-naphthoxy substituent on the phosphorus, shows the highest regioselectivity toward the linear aldehyde. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.02.035
• 作为产物：
  描述：

  间苯二甲醛 、 4-叔丁基苯酚 在 盐酸 作用下， 以 水 为溶剂， 反应 6.0h， 以71.5%的产率得到1,3-bis(5,5'-di-tert-butyl-2,2'-dihydroxydiphenylmethyl)benzene
  参考文献：
  名称：

  ORGANOPHOSPHORUS COMPOUNDS BASED ON TETRAPHENOL (TP)-SUBSTITUTED STRUCTURES

  摘要：

  该发明涉及合成四苯基取代结构，特别是间位取代二甲苯。所述四苯酚型结构被反应以获得有机磷化合物，特别是有机磷酸酯。该发明还涉及生产含有过渡金属的催化活性组合物，除了上述有机磷化合物。根据该发明的另一主题，所述催化活性组合物在与小分子的化学反应中使用，例如HCN、CO、氢和胺。

  公开号：

  US20120197025A1

文献信息

• ORGANOPHOSPHORUS COMPOUNDS BASED ON TETRAPHENOL (TP)-SUBSTITUTED STRUCTURES
  申请人：Christiansen Andrea

  公开号：US20120197025A1

  公开（公告）日：2012-08-02

  The invention relates to the synthesis of tetraphenol-substituted structures, in particular meta-substituted xylenes. Said tetraphenol-type structures are reacted to obtain organic phosphorus compounds, in particular organophosphites. The invention further relates to the production of catalytically active compositions which contain transition metals in addition to the aforementioned organic phosphorus compounds. According to another subject matter of the invention, said catalytically active compositions are used in chemical reactions with small molecules, e.g. HCN, CO, hydrogen, and amines.

  该发明涉及合成四苯基取代结构，特别是间位取代二甲苯。所述四苯酚型结构被反应以获得有机磷化合物，特别是有机磷酸酯。该发明还涉及生产含有过渡金属的催化活性组合物，除了上述有机磷化合物。根据该发明的另一主题，所述催化活性组合物在与小分子的化学反应中使用，例如HCN、CO、氢和胺。
• Sartori, Giovanni; Bigi, Franca; Maggi, Raimondo, Journal of the Chemical Society. Perkin transactions I, 1994, # 13, p. 1879 - 1882
  作者：Sartori, Giovanni、Bigi, Franca、Maggi, Raimondo、Pastorio, Andrea、Porta, Cecilia、Bonfanti, Gianmarco

  DOI：——

  日期：——
• Sartori Giovanni, Bigi Franca, Maggi Raimondo, Pastorio Andrea, Porta Cec+, J. Chem. Soc. Dalton Trans, (1994) N 13, S 1879-1882
  作者：Sartori Giovanni, Bigi Franca, Maggi Raimondo, Pastorio Andrea, Porta Cec+

  DOI：——

  日期：——
• US9000220B2
  申请人：——

  公开号：US9000220B2

  公开（公告）日：2015-04-07
• Tetraphenol-based diphosphite ligands: synthesis, characterization, and application in the rhodium-catalyzed hydroformylation of octenes
  作者：Michèle Janssen、Laura Bini、Bart Hamers、Christian Müller、Dieter Hess、Andrea Christiansen、Robert Franke、Dieter Vogt

  DOI：10.1016/j.tetlet.2010.02.035

  日期：2010.4

  A new class of diphosphites is described, based on a tetraphenol backbone. Ligands TP1-TP5 were synthesized and fully characterized and their application in the hydroformylation of octenes was investigated. Ligand TP3, bearing a 1-naphthoxy substituent on the phosphorus, shows the highest regioselectivity toward the linear aldehyde. (C) 2010 Elsevier Ltd. All rights reserved.