8-[2-[[3,5-Bis[2-[(2-methylquinolin-8-yl)oxymethyl]prop-2-enoxymethyl]phenyl]methoxymethyl]prop-2-enoxy]-2-methylquinoline | 213483-88-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 8-[2-[[3,5-Bis[2-[(2-methylquinolin-8-yl)oxymethyl]prop-2-enoxymethyl]phenyl]methoxymethyl]prop-2-enoxy]-2-methylquinoline
• CAS: 213483-88-6
• 化学式: C₅₁H₅₁N₃O₆
• 分子量: 801.982
• InChiKey: VAHQRCQIIXLPKV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10
• 重原子数：
  60
• 可旋转键数：
  21
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  94
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  8-[2-[[3,5-Bis[2-[(2-methylquinolin-8-yl)oxymethyl]prop-2-enoxymethyl]phenyl]methoxymethyl]prop-2-enoxy]-2-methylquinoline 以 neat (no solvent) 为溶剂， 以76%的产率得到7-[2-[[3,5-Bis[2-[(8-hydroxy-2-methylquinolin-7-yl)methyl]prop-2-enoxymethyl]phenyl]methoxymethyl]prop-2-enyl]-2-methylquinolin-8-ol
  参考文献：
  名称：

  Synthesis and binding properties of new tripodal hexadentate ligands having three quinolinol moieties for trivalent metal cations

  摘要：

  Tripodal hexadentate ligands, having three 8-hydroxyquinolyl or 2-methyl-8-hydroxyquinolyl groups as binding sites, were successfully prepared from the corresponding tris(isobutenyl 8-quinolyl ether) via the Claisen rearrangement. The 2-methyl-8-hydroxyquinolyl derivative exhibited binding ability for several kinds of trivalent metal cations to form 1:1 complexes, and showed selective extractability for Ga3+ among trivalent cations of Group 13 elements. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)01277-5
• 作为产物：
  描述：

  2-Methyl-8-[2-(oxan-2-yloxymethyl)prop-2-enoxy]quinoline 在 sodium hydride 、 对甲苯磺酸 作用下， 以 甲醇 、 乙二醇二甲醚 为溶剂， 生成 8-[2-[[3,5-Bis[2-[(2-methylquinolin-8-yl)oxymethyl]prop-2-enoxymethyl]phenyl]methoxymethyl]prop-2-enoxy]-2-methylquinoline
  参考文献：
  名称：

  Synthesis and binding properties of new tripodal hexadentate ligands having three quinolinol moieties for trivalent metal cations

  摘要：

  Tripodal hexadentate ligands, having three 8-hydroxyquinolyl or 2-methyl-8-hydroxyquinolyl groups as binding sites, were successfully prepared from the corresponding tris(isobutenyl 8-quinolyl ether) via the Claisen rearrangement. The 2-methyl-8-hydroxyquinolyl derivative exhibited binding ability for several kinds of trivalent metal cations to form 1:1 complexes, and showed selective extractability for Ga3+ among trivalent cations of Group 13 elements. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)01277-5