bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)diselenide | 383909-73-7

• 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: bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)diselenide
• 英文别名: bis-(4-benzoyl-5-methyl-2-phenyl-2H-pyrazol-3-yl)-diselenide；Bis-(4-benzoyl-5-methyl-2-phenyl-2H-pyrazol-3-yl)-diselenid；[5-[(4-Benzoyl-5-methyl-2-phenylpyrazol-3-yl)diselanyl]-3-methyl-1-phenylpyrazol-4-yl]-phenylmethanone；[5-[(4-benzoyl-5-methyl-2-phenylpyrazol-3-yl)diselanyl]-3-methyl-1-phenylpyrazol-4-yl]-phenylmethanone
• CAS: 383909-73-7
• 化学式: C₃₄H₂₆N₄O₂Se₂
• 分子量: 680.526
• InChiKey: BHIYSUMURXRYHM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.41
• 重原子数：
  42
• 可旋转键数：
  9
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  69.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  双氧水 、 溶剂黄146 、 bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)diselenide 生成 alkaline earth salt of/the/ methylsulfuric acid
  参考文献：
  名称：

  Michaelis; Langenkamp, Justus Liebigs Annalen der Chemie, 1914, vol. 404, p. 28

  摘要：

  DOI：
• 作为产物：
  描述：

  5-Chlor-3-Methyl-1-phenyl-4-benzoyl-pyrazol 在 potassium hydroselenide 作用下， 以 乙醇 为溶剂， 反应 1.0h， 生成 bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)diselenide
  参考文献：
  名称：

  The structure of 1-phenyl-3-methyl-4-benzoylpyrazol-2-in-5-selenone and its derivatives

  摘要：

  It is shown that 1-phenyl-3-methyl-4-benzoylpyrazol-2-in-5-selenone exists in a SeH-tautomeric form in the solid phase. Crystal and molecular structure of bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)selenide as a supplementary product of the synthesis of selenopyrazolone and di(1-phenyl-3-methyl-4-benzoylselenopyrazolyl-5)diselenide as the product of oxidation of the latter were characterised by X-ray single crystal diffraction. (C) 2001 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0022-2860(01)00478-1

文献信息

• The structure of 1-phenyl-3-methyl-4-benzoylpyrazol-2-in-5-selenone and its derivatives
  作者：A.R. Kurbangalieva、A.I. Movchan、O.N. Kataeva、I.A. Litvinov、G.A. Chmutova

  DOI：10.1016/s0022-2860(01)00478-1

  日期：2001.9

  It is shown that 1-phenyl-3-methyl-4-benzoylpyrazol-2-in-5-selenone exists in a SeH-tautomeric form in the solid phase. Crystal and molecular structure of bis(1-phenyl-3-methyl-4-benzoylpyrazolyl-5)selenide as a supplementary product of the synthesis of selenopyrazolone and di(1-phenyl-3-methyl-4-benzoylselenopyrazolyl-5)diselenide as the product of oxidation of the latter were characterised by X-ray single crystal diffraction. (C) 2001 Elsevier Science B.V. All rights reserved.
• Michaelis; Langenkamp, Justus Liebigs Annalen der Chemie, 1914, vol. 404, p. 28
  作者：Michaelis、Langenkamp

  DOI：——

  日期：——