2-羟基-3-甲氧基-5-(4-甲基苯基)苯甲醛 | 825613-03-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 2-羟基-3-甲氧基-5-(4-甲基苯基)苯甲醛
• 英文名称: 4-Hydroxy-5-methoxy-4'-methyl[1,1'-biphenyl]-3-carbaldehyde
• 英文别名: 2-hydroxy-3-methoxy-5-(4-methylphenyl)benzaldehyde
• CAS: 825613-03-4
• 化学式: C₁₅H₁₄O₃
• 分子量: 242.274
• InChiKey: WHINDHPAHJRWPF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-羟基-3-甲氧基-5-(4-甲基苯基)苯甲醛 、 N-(5-(4-cyanophenyl)-3-methoxysalicylidene)-phenylene-1,2-diamine 、 zinc(II) acetate dihydrate 以 乙醇 为溶剂， 反应 12.0h， 生成
  参考文献：
  名称：

  Synthesis and two-photon absorption properties of unsymmetrical metallosalophen complexes

  摘要：

  Several new unsymmetrical metallosalphen complexes derived from the condensation of a monoimine and salicylaldehyde in the presence of a transition metal ion as a template have been synthesized and characterized. Their linear and third-order non-linear optical (NLO) properties have been investigated in detail. With different substituted donor or acceptor groups at the 5-position of the salicylidene fragment, these metallosalophen complexes exhibit slightly different two-photon absorption (TPA) cross-section sigma((2)) values. Theoretical calculations based on density functional theory were also carried out to help with the interpretations of the experimental results. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2012.09.050
• 作为产物：
  描述：

  2-羟基-5-碘-3-甲氧基苯甲醛 、 4-甲苯硼酸 在 四(三苯基膦)钯 、 sodium carbonate 作用下， 以 甲苯 为溶剂， 生成 2-羟基-3-甲氧基-5-(4-甲基苯基)苯甲醛
  参考文献：
  名称：

  Synthesis and two-photon absorption properties of unsymmetrical metallosalophen complexes

  摘要：

  Several new unsymmetrical metallosalphen complexes derived from the condensation of a monoimine and salicylaldehyde in the presence of a transition metal ion as a template have been synthesized and characterized. Their linear and third-order non-linear optical (NLO) properties have been investigated in detail. With different substituted donor or acceptor groups at the 5-position of the salicylidene fragment, these metallosalophen complexes exhibit slightly different two-photon absorption (TPA) cross-section sigma((2)) values. Theoretical calculations based on density functional theory were also carried out to help with the interpretations of the experimental results. (c) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2012.09.050