4-methyl-2,6-bis(1-naphthylmethyliminomethyl)phenol | 1159279-10-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: 4-methyl-2,6-bis(1-naphthylmethyliminomethyl)phenol
• 英文别名: 4-Methyl-2,6-bis(naphthalen-1-ylmethyliminomethyl)phenol
• CAS: 1159279-10-3
• 化学式: C₃₁H₂₆N₂O
• 分子量: 442.56
• InChiKey: AEIVJGFRTBRMDV-UHFFFAOYSA-N

物化性质

• 沸点：
  663.8±55.0 °C(predicted)
• 密度：
  1.12±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  45
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-methyl-2,6-bis(1-naphthylmethyliminomethyl)phenol 、 zinc(II) acetate dihydrate 、 乙腈 以60%的产率得到[Zn6(4-methyl-2,6-bis(1-naphthylmethyliminomethyl)phenolate)2(OH)2(CH3COO)8]*4CH3CN
  参考文献：
  名称：

  Synthesis, characterization and fluorescence properties of hexanuclear zinc(II) complexes

  摘要：

  Two hexanuclear zinc(II) complexes, [Zn-6(L-1)(2)(mu(2)-OH)(2)(mu(2)-CH3COO)(8)]center dot CH3CN (1 CH3CN) and [Zn-6(L-2)(2-) (mu(2)-OH)(2)(mu(2)-CH3COO)(8)]center dot 4CH(3)CN (2 4CH(3)CN), where HL1 = 4-methyl-2,6-bis(cyclohexylmethyliminomethyl)- and HL2 = 4-phenyl-2,6-bis(1-naphthalylmethyliminomethyl)-phenol, have been synthesized and characterized by elemental analysis, FT-IR and fluorescence spectroscopic methods, and by X-ray diffraction analysis. In the asymmetric unit of complex 1, two of the three zinc atoms have pentacoordinate geometries and the other is tetrahedrally coordinated, whereas the three distinct Zn atoms in complex 2 adopt three different coordination environments, namely distorted octahedral. trigonal bipyramidal and tetrahedral. The fluorescence properties of the ligands and complexes have been investigated. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2009.01.042