4-benzoyloxime-3-methyl-1-phenyl-2-pyrazoline-5-one | 59261-47-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑啉类
• 英文名称: 4-benzoyloxime-3-methyl-1-phenyl-2-pyrazoline-5-one
• 英文别名: benzoyl-1-phenyl-3-methyl-2-pyrazolin-5-one；4-(N-hydroxy-C-phenylcarbonimidoyl)-5-methyl-2-phenyl-4H-pyrazol-3-one
• CAS: 59261-47-1
• 化学式: C₁₇H₁₅N₃O₂
• 分子量: 293.325
• InChiKey: MVRJKCVBRDYVOI-UHFFFAOYSA-N

物化性质

• 沸点：
  526.5±43.0 °C(Predicted)
• 密度：
  1.25±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  65.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  chromium(III) nitrate 、 4-benzoyloxime-3-methyl-1-phenyl-2-pyrazoline-5-one 在 sodium acetate 作用下， 以 乙醇 为溶剂， 生成
  参考文献：
  名称：

  Rana, A. K.; Shah, J. R., Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1981, vol. 20, # 2, p. 142 - 144

  摘要：

  DOI：

文献信息

• Synthesis, Magnetic, and Spectral Studies of Mixed‐Ligand Complexes of Nickel(II) Involving Some Chelating 4‐Oximino‐2‐pyrazoline‐5‐one Derivatives
  作者：R. C. Maurya、R. Verma、D. Sutradhar

  DOI：10.1081/sim-120019997

  日期：2003.1.6

  The synthesis, magnetic and spectral studies of mixed-ligand complexes of nickel(II) derived from chelating 4-oximino-2-pyrazoline-5-one derivatives, viz., 4-benzoyloxime-3-methyl-1-phenyl-2-pyrazoline-5-one (bomppH), 4-acetyloxime-3-methyl-1-phenyl-2-pyrazoline-5-one (aomppH) and 3-methyl-1-phenyl-4-propionyloxime-2-pyrazoline-5-one (mppopH), and certain heterocyclic ligands, viz., 3-methyl-1-phenyl-2-pyrazoline-5-one (mpp), 4-amino-2,3-dimethyl-1-phenyl-3-pyrazoline-5-one (adpp), 2,3-dimethyl-1-phenyl-3-pyrazoline-5-one (dpp), 2,3-dimethyl-4-methylaminomethanesulfonate sodium-1-phenyl-3-pyrazoline-5-one (dmspp), benzimidazole (bzl) and benzothiazole (bzt) are described. The complexes, which have been characterized by conducts ance measurements, electron spin resonance, magnetic measurements, thermogravimetric analyses, electronic and infrared spectral studies have the general formulas [Ni(A-A)(2)(L)(2)] and [Ni(A-A)(2)(L-L)] where, (A-A)H = bomppH, aomppH, or mppopH, L = mpp, dpp, bzl or bzt and L - L = adpp or dmspp. All the complexes were found to be non-electrolytes and octahedral structures have been proposed for them.
• Rana, A. K.; Shah, J. R., Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1981, vol. 20, # 2, p. 142 - 144
  作者：Rana, A. K.、Shah, J. R.

  DOI：——

  日期：——