5,11,17,23-tetra(tert-butyl)-26,27,28-tris<(6-methyl-2,2'-bipyridyl-6'-yl)methoxy>calix<4>arene-25-ol | 162845-60-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 5,11,17,23-tetra(tert-butyl)-26,27,28-tris<(6-methyl-2,2'-bipyridyl-6'-yl)methoxy>calix<4>arene-25-ol
• 英文别名: 5,11,17,23-Tetratert-butyl-26,27,28-tris[[6-(6-methylpyridin-2-yl)pyridin-2-yl]methoxy]pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15,17,19(26),21(25),22-dodecaen-25-ol
• CAS: 162845-60-5
• 化学式: C₈₀H₈₆N₆O₄
• 分子量: 1195.6
• InChiKey: RBWILZIARHHASW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  18.4
• 重原子数：
  90
• 可旋转键数：
  16
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  125
• 氢给体数：
  1
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  1-(3-溴丙氧基)-4-硝基苯 、 5,11,17,23-tetra(tert-butyl)-26,27,28-tris<(6-methyl-2,2'-bipyridyl-6'-yl)methoxy>calix<4>arene-25-ol 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以93%的产率得到C₈₉H₉₅N₇O₇
  参考文献：
  名称：

  A bifunctional calixarene designed for immobilisation on a natural polymer and for metal complexation

  摘要：

  The present work describes the multi-step synthesis of a new bifunctional calix[4]arene designed for grafting on natural polymeric materials, such as water-soluble dextrans, and for metal complexation. The podand was then anchored to the polymer by means of a cyanuric linker. The resulting material showed an interesting ability to complex copper(I), giving stable yellowish light orange solids and aqueous solutions. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)02203-7
• 作为产物：
  描述：

  6-(bromomethyl)-6'-methyl-2,2'-bipyridine 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 7.0h， 生成 5,11,17,23-tetra(tert-butyl)-26,27,28-tris<(6-methyl-2,2'-bipyridyl-6'-yl)methoxy>calix<4>arene-25-ol
  参考文献：
  名称：

  基于圆锥构型的四-对-（叔丁基）杯[4]芳烃和联吡啶亚基的新型受体的合成和络合特性

  摘要：

  0The联吡啶武装四- p - （叔丁基）杯[4]芳烃1 - 5是从四-合成p - （叔丁基）-calix [4]芳烃甲和6-（溴甲基）-6'-甲基-2,2'-联吡啶（B）通过直接碱强度驱动的区域选择性O烷基化或逐步操作来实现。的配位体的络合初步研究1 - 3与铜我得到的配合物6 - 8中描述。

  DOI：

  10.1002/hlca.19940770713

文献信息

• A bifunctional calixarene designed for immobilisation on a natural polymer and for metal complexation
  作者：Philippe Engrand、Jean-Bernard Regnouf-de-Vains

  DOI：10.1016/s0040-4039(02)02203-7

  日期：2002.12

  The present work describes the multi-step synthesis of a new bifunctional calix[4]arene designed for grafting on natural polymeric materials, such as water-soluble dextrans, and for metal complexation. The podand was then anchored to the polymer by means of a cyanuric linker. The resulting material showed an interesting ability to complex copper(I), giving stable yellowish light orange solids and aqueous solutions. (C) 2002 Elsevier Science Ltd. All rights reserved.
• Synthesis and Complexation Properties of a New Class of Receptors based on a cone-configurated tetra-p-(tert-butyl)calix[4]arene and bipyridyl subunits
  作者：Jean-Bernard Regnouf de Vains、Roger Lamartine

  DOI：10.1002/hlca.19940770713

  日期：1994.11.2

  0The bipyridyl-armed tetra-p-(tert-butyl)calix[4]arenes 1–5 were synthesized from tetra-p-(tert-butyl)-calix[4]arene A and 6-(bromomethyl)-6′-methyl-2,2′-bipyridine (B) by direct base-strength-driven regioselective O-alkylation or by stepwise procedures. Preliminary complexation studies of the ligands 1–3 with CuI affording the complexes 6–8 are described.

  0The联吡啶武装四- p - （叔丁基）杯[4]芳烃1 - 5是从四-合成p - （叔丁基）-calix [4]芳烃甲和6-（溴甲基）-6'-甲基-2,2'-联吡啶（B）通过直接碱强度驱动的区域选择性O烷基化或逐步操作来实现。的配位体的络合初步研究1 - 3与铜我得到的配合物6 - 8中描述。