p-ClC6H4CHC(CMeNNHPh)2 | 354579-58-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: p-ClC6H4CHC(CMeNNHPh)2
• CAS: 354579-58-1
• 化学式: C₂₄H₂₃ClN₄
• 分子量: 402.926
• InChiKey: JFUVRVBXXKTSEW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  29.0
• 可旋转键数：
  7.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  48.78
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  chromium(III) nitrate nonahydrate 、 p-ClC6H4CHC(CMeNNHPh)2 以 乙醇 为溶剂， 以76%的产率得到[Cr(ClC6H4CHC(CMeNNHPh)2)(H2O)2(NO3)2]NO3*2H2O
  参考文献：
  名称：

  SYNTHESIS AND SPECTROSCOPIC STUDIES OF TiO(II), VO(II), AND Cr(III) COMPLEXES WITH SOME β-DIKETONE DIHYDRAZONE DERIVATIVES

  摘要：

  Titanium(IV), vanadium(IV) and chromium(III) complexes of some new B-diketone dihydrazone derivatives have been synthesized and studied spectroscopically, by elemental and thermal analyses, magnetic susceptibility measurements, conductance in DMF, IR and electronic absorption spectra and precipitimetric determination of TIO(II), VO(II) and Cr(III) ions. The results revealed the formation of octahedral (1:1) complexes with TiO(IV), VO(IV) and Cr(III) ions. The organic ligands behave as weak bidentate chelating agents.

  DOI：

  10.1081/sim-100002049
• 作为产物：
  描述：

  3-(4-chlorobenzylidene)pentane-2,4-dione 、 苯肼 在 盐酸 作用下， 以 乙醇 、 水 为溶剂， 以83%的产率得到p-ClC6H4CHC(CMeNNHPh)2
  参考文献：
  名称：

  Synthesis, Characterization, and Biological Activities of Lanthanide(III) Complexes of β-Diketone Hydrazone Derivatives

  摘要：

  A series of beta-diketone hydrazone derivatives has been synthesized through condensation of beta-diketone with aromatic aldehydes followed by reaction with phenylhydrazine. The structures of the ligands and intermediates are well defined through elemental and spectroscopic analyses. These hydrazones are potential ligands toward lanthanide metal ions. New complexes of trivalent scandium, yttrium, lanthanum, and cerium have been synthesized. The composition of these complexes is discussed on the basis of elemental analyses, infrared (IR) spectroscopy, magnetic moments and thermal analyses. The ligands are supposed to be bidentate with the two-sp2 nitrogen atoms. The prepared (1:1) metal: ligand complexes were screened for antibacterial and antifungal properties and have exhibited potential activity. Scandium(III) complexes are more active toward bacterium, yeast, and fungi.

  DOI：

  10.1080/15533174.2011.591645