2-[[2-(4-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxy]-2,3-bis-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxymethyl]but-2-enyloxy)naphthalen-1-ylmethylene]amino]ethanol | 1315576-59-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 2-[[2-(4-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxy]-2,3-bis-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxymethyl]but-2-enyloxy)naphthalen-1-ylmethylene]amino]ethanol
• 英文别名: 2-[[2-[4-[1-(2-Hydroxyethyliminomethyl)naphthalen-2-yl]oxy-2,3-bis[[1-(2-hydroxyethyliminomethyl)naphthalen-2-yl]oxymethyl]but-2-enoxy]naphthalen-1-yl]methylideneamino]ethanol；2-[[2-[4-[1-(2-hydroxyethyliminomethyl)naphthalen-2-yl]oxy-2,3-bis[[1-(2-hydroxyethyliminomethyl)naphthalen-2-yl]oxymethyl]but-2-enoxy]naphthalen-1-yl]methylideneamino]ethanol
• CAS: 1315576-59-0
• 化学式: C₅₈H₅₆N₄O₈
• 分子量: 937.105
• InChiKey: RWJDRVCUNAFGMC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  70
• 可旋转键数：
  24
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  167
• 氢给体数：
  4
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  zinc perchlorate 、 2-[[2-(4-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxy]-2,3-bis-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxymethyl]but-2-enyloxy)naphthalen-1-ylmethylene]amino]ethanol 以 乙醇 、 氯仿 为溶剂， 以71%的产率得到(2-[(2-[4-[1-((2-oxyethylimino)methyl)naphthalen-2-yloxy]-2,3-bis[1-((2-oxyethylimino)methyl)naphthalen-2-yloxymethyl]but-2-enyloxy]naphthalen-1-ylmethylene)amino]ethanolato)dizinc(II)
  参考文献：
  名称：

  Synthesis and spectroscopic studies of homo-binuclear, alkoxo bridged homo- and hetero-tetranuclear metal complexes of a bis-N2O4 Schiff base ligand derived from ethanolamine and macroacyclic tetranaphthaldehyde

  摘要：

  Three new homo-binuclear Ni(II), Cu(II), Zn(II) complexes (2-4), homo-tetranuclear Cu(II) complex (5), and hetero-tetranuclear Cu(II)-Ni(II) complex (6) of a macroacyclic potentially bis-hexadentate N2O4 Schiff base have been synthesized. The imino-alcohol ligand, H4L was obtained by the condensation of ethanolamine with 2,2'-[2,3-bis(1-formyl-2-naphthyloxymethyl)-but-2-ene-1,4-diyldioxy]bis(naphthalene-1-carbaldehyde). The structures of both the Schiff base and its complexes have been proposed by elemental analyses, spectroscopic data i.e. IR, H-1 and C-13 NMR, UV-vis, electrospray ionisation mass spectra, molar conductivities and magnetic susceptibility measurements. The ligand has two similar compartments to bind first primary two metal ions, and acts bi- or tetra-negative, bis-tetradentate forming five membered chelate ring. However, secondary two metal ions (either Cu2+ or Ni2+.) are ligated with dianionic oxygen atoms of the alcohol groups and are linked to the 1,10-phenanthroline-nitrogen atoms in the tetranuclear complexes (5 and 6). (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2011.03.015
• 作为产物：
  描述：

  2,2'-[2,3-bis(1-formyl-2-naphthyloxymethyl)-but-2-ene-1,4-diyldioxy]bis(naphthalene-1-carbaldehyde) 、 C.I.酸性橙108 反应 246.0h， 以65%的产率得到2-[[2-(4-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxy]-2,3-bis-[1-[(2-hydroxyethylimino)methyl]naphthalen-2-yloxymethyl]but-2-enyloxy)naphthalen-1-ylmethylene]amino]ethanol
  参考文献：
  名称：

  Synthesis and spectroscopic studies of homo-binuclear, alkoxo bridged homo- and hetero-tetranuclear metal complexes of a bis-N2O4 Schiff base ligand derived from ethanolamine and macroacyclic tetranaphthaldehyde

  摘要：

  Three new homo-binuclear Ni(II), Cu(II), Zn(II) complexes (2-4), homo-tetranuclear Cu(II) complex (5), and hetero-tetranuclear Cu(II)-Ni(II) complex (6) of a macroacyclic potentially bis-hexadentate N2O4 Schiff base have been synthesized. The imino-alcohol ligand, H4L was obtained by the condensation of ethanolamine with 2,2'-[2,3-bis(1-formyl-2-naphthyloxymethyl)-but-2-ene-1,4-diyldioxy]bis(naphthalene-1-carbaldehyde). The structures of both the Schiff base and its complexes have been proposed by elemental analyses, spectroscopic data i.e. IR, H-1 and C-13 NMR, UV-vis, electrospray ionisation mass spectra, molar conductivities and magnetic susceptibility measurements. The ligand has two similar compartments to bind first primary two metal ions, and acts bi- or tetra-negative, bis-tetradentate forming five membered chelate ring. However, secondary two metal ions (either Cu2+ or Ni2+.) are ligated with dianionic oxygen atoms of the alcohol groups and are linked to the 1,10-phenanthroline-nitrogen atoms in the tetranuclear complexes (5 and 6). (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2011.03.015

文献信息

• Synthesis and spectroscopic studies of homo-binuclear, alkoxo bridged homo- and hetero-tetranuclear metal complexes of a bis-N2O4 Schiff base ligand derived from ethanolamine and macroacyclic tetranaphthaldehyde
  作者：Kaan Karaoğlu、Talat Baran、İsmail Değirmencioğlu、Kerim Serbest

  DOI：10.1016/j.saa.2011.03.015

  日期：2011.9

  Three new homo-binuclear Ni(II), Cu(II), Zn(II) complexes (2-4), homo-tetranuclear Cu(II) complex (5), and hetero-tetranuclear Cu(II)-Ni(II) complex (6) of a macroacyclic potentially bis-hexadentate N2O4 Schiff base have been synthesized. The imino-alcohol ligand, H4L was obtained by the condensation of ethanolamine with 2,2'-[2,3-bis(1-formyl-2-naphthyloxymethyl)-but-2-ene-1,4-diyldioxy]bis(naphthalene-1-carbaldehyde). The structures of both the Schiff base and its complexes have been proposed by elemental analyses, spectroscopic data i.e. IR, H-1 and C-13 NMR, UV-vis, electrospray ionisation mass spectra, molar conductivities and magnetic susceptibility measurements. The ligand has two similar compartments to bind first primary two metal ions, and acts bi- or tetra-negative, bis-tetradentate forming five membered chelate ring. However, secondary two metal ions (either Cu2+ or Ni2+.) are ligated with dianionic oxygen atoms of the alcohol groups and are linked to the 1,10-phenanthroline-nitrogen atoms in the tetranuclear complexes (5 and 6). (C) 2011 Elsevier B.V. All rights reserved.