2-(5-Hydroxypentyliminomethyl)phenol | 203641-69-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-(5-Hydroxypentyliminomethyl)phenol
• 英文别名: 2-(5-hydroxypentyliminomethyl)phenol
• CAS: 203641-69-4
• 化学式: C₁₂H₁₇NO₂
• 分子量: 207.272
• InChiKey: GGAHNTTULQPGAK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  52.8
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  nickel(II) chloride hexahydrate 、 2-(5-Hydroxypentyliminomethyl)phenol 在 三乙胺 作用下， 以 甲醇 为溶剂， 反应 3.0h， 以70%的产率得到
  参考文献：
  名称：

  Syntheses, crystallographic characterization, catecholase activity and magnetic properties of three novel aqua bridged dinuclear nickel(II) complexes

  摘要：

  Three novel mu(2)-aqua bridged dinuclear Ni(II) complexes, [Ni-2(HL1)(4)(H2O)] (1), [Ni-2(HL2)(4)(H2O)] (2) and [Ni-2(HL3)(4)(H2O)] (3) have been synthesized using Schiff base ligands derived from 5-amino-1-pentanol and salicylaldehyde (H2L1), 5-bromo salicylaldehyde (H2L2) and 3-methoxy salicylaldehyde (H2L3), respectively. They are characterized by a variety of physical techniques including elemental analysis, infrared and UV-Vis spectroscopy, NMR, cyclic voltammetry, variable temperature magnetic measurements and single crystal X-ray diffraction. X-ray crystallographic analysis reveals that all the three complexes possess distorted octahedral environment with a bridging aqua ligand. Complexes 1 and 3 exhibit 3D supramolecular architecture whereas 2 demonstrates a 2D netlike arrangement along ab plane. Catecholase activity of the dinuclear Ni(II) systems are investigated using 3,5-di-tert-butylcatechol as the substrate. The complexes are efficient catalysts with turnover numbers 1.87 x 10(4), 1.79 x 10(4) and 1.38 x 10(4) h (1) for 1, 2 and 3, respectively. The probable structures of the intermediates formed during the process are proposed on the basis of kinetic and spectral analyses. The magnetic data disclose that weak ferromagnetic couplings are transmitted between the metal centers and the magnetic properties are correlated with the structural features around the Ni(II) centers. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2014.03.008
• 作为产物：
  描述：

  5-氨基-1-戊醇 、 水杨醛 以 甲醇 为溶剂， 反应 0.5h， 以87%的产率得到2-(5-Hydroxypentyliminomethyl)phenol
  参考文献：
  名称：

  Syntheses, crystallographic characterization, catecholase activity and magnetic properties of three novel aqua bridged dinuclear nickel(II) complexes

  摘要：

  Three novel mu(2)-aqua bridged dinuclear Ni(II) complexes, [Ni-2(HL1)(4)(H2O)] (1), [Ni-2(HL2)(4)(H2O)] (2) and [Ni-2(HL3)(4)(H2O)] (3) have been synthesized using Schiff base ligands derived from 5-amino-1-pentanol and salicylaldehyde (H2L1), 5-bromo salicylaldehyde (H2L2) and 3-methoxy salicylaldehyde (H2L3), respectively. They are characterized by a variety of physical techniques including elemental analysis, infrared and UV-Vis spectroscopy, NMR, cyclic voltammetry, variable temperature magnetic measurements and single crystal X-ray diffraction. X-ray crystallographic analysis reveals that all the three complexes possess distorted octahedral environment with a bridging aqua ligand. Complexes 1 and 3 exhibit 3D supramolecular architecture whereas 2 demonstrates a 2D netlike arrangement along ab plane. Catecholase activity of the dinuclear Ni(II) systems are investigated using 3,5-di-tert-butylcatechol as the substrate. The complexes are efficient catalysts with turnover numbers 1.87 x 10(4), 1.79 x 10(4) and 1.38 x 10(4) h (1) for 1, 2 and 3, respectively. The probable structures of the intermediates formed during the process are proposed on the basis of kinetic and spectral analyses. The magnetic data disclose that weak ferromagnetic couplings are transmitted between the metal centers and the magnetic properties are correlated with the structural features around the Ni(II) centers. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2014.03.008