3,3'-[Hexane-1,6-diylbis(oxy)]dibenzoyl chloride | 110589-12-3

• 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: 3,3'-[Hexane-1,6-diylbis(oxy)]dibenzoyl chloride
• 英文别名: 3-[6-(3-carbonochloridoylphenoxy)hexoxy]benzoyl chloride
• CAS: 110589-12-3
• 化学式: C₂₀H₂₀Cl₂O₄
• 分子量: 395.282
• InChiKey: CGKPEJVQPCXDQH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  26
• 可旋转键数：
  11
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3,3'-[Hexane-1,6-diylbis(oxy)]dibenzoyl chloride 、 {copper(II)(Me4Bzo2{14}tetraeneN4)} 在 三乙胺 作用下， 以 甲苯 为溶剂， 以23%的产率得到copper;(22E)-23,32,33,42-tetramethyl-8,15-dioxa-24,34-diaza-31,41-diazanidahexacyclo[20.10.10.13,7.116,20.025,30.035,40]tetratetraconta-1(32),3(44),4,6,16,18,20(43),22(42),23,25,27,29,33,35,37,39-hexadecaene-2,21-dione
  参考文献：
  名称：

  Preparation and Characterization of Four Strapped Tetraaza[14]annulene Copper(II) Complexes

  摘要：

  The reaction between a tetraaza[14]annulene copper(II) complex and four dibenzoic dichlorides led to the corresponding strapped copper(II) complexes in 21-53 % yield at 70 degrees C in dry toluene containing excess, triethylamine. The mass spectra reveal the molecular ion signals caused by the strapped products, respectively. The infrared spectra exhibit the intense stretching mode of C=O in the 1650-1660 cm(-1) range and the two strong stretching modes of C-O-C at about 1250 cm(-1) and 1050 cm(-1). All elemental analyses of the strapped copper(II) complexes agree with the anticipated constitution. These copper(II) complexes assume roughly square-planar coordination based on their d-->d* transition bands. The spin Hamiltonian parameters are consistent with those of the copper(II) complex which is not strapped which is square-planar with an unpaired electron in the dx(2)-y(2) orbital. These results support the structure of the strapped complexes.

  DOI：

  10.1080/00945719608004367

文献信息

• Exceptional efficacy of some new lacunar dioxygen carriers based on Schiff bases derived from .beta.-diketones and triamines
  作者：Rita Delgado、Mark W. Glogowski、Daryle H. Busch

  DOI：10.1021/ja00256a052

  日期：1987.10

  Synthese de complexes de bases de Schiff qui ont de tres fortes affinites pour O 2 ; une forte resistance a l'autooxydation marque les complexes

  Synthese de complexes de bases de Schiff qui ont de tres fortes affinites pour O 2 ；une forte resistance a l'autooxydation marque les complexes
• Davis, William M.; Dzugan, Sharlene J.; Glogowski, Mark W., Inorganic Chemistry, <hi>1991</hi>, vol. 30, # 13, p. 2724 - 2731
  作者：Davis, William M.、Dzugan, Sharlene J.、Glogowski, Mark W.、Delgado, Rita、Busch, Daryle H.

  DOI：——

  日期：——