bis-(3,5-dimethylpyrazolyl-4)sulfide | 1186339-64-9

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: bis-(3,5-dimethylpyrazolyl-4)sulfide
• CAS: 1186339-64-9
• 化学式: C₁₀H₁₄N₄S
• 分子量: 222.314
• InChiKey: WRXCRPWGIRWPJW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.52
• 重原子数：
  15.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  57.36
• 氢给体数：
  2.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  bis(2,2-difluoro-4,6-dimethyl-2H-1l3,3,2l4-dioxaborinin-5-yl)sulfane 在 盐酸肼 、 氨 作用下， 以 乙醇 、 水 为溶剂， 反应 0.67h， 生成 bis-(3,5-dimethylpyrazolyl-4)sulfide
  参考文献：
  名称：

  α-substituted boron difluoride acetylacetonates

  摘要：

  By treatment of a-substituted acetylacetone derivatives with boron trifluoride etherate a series of earlier unknown boron difluoride complexes is obtained. The series includes binuclear complexes containing boron in the chelate fragment connected via sulfur or selenium atom. Gas chromatographic and spectral characteristics of the obtained compounds were investigated. By means of chromato-mass spectrometry their reaction with hydrazine in acidic and alkaline media was studied.

  DOI：

  10.1134/s1070363208080094

文献信息

• Reactions of sulfenyl- and selenylchlorides of boron difluoride acetylacetonate with C-H acids
  作者：Irina V. Svistunova、Galina O. Tretyakova、Ksenia A. Gaivoronskaya

  DOI：10.1080/10426507.2017.1354210

  日期：2017.11.2

  selenylchloride derivatives of boron difluoride acetylacetonate with ketones, diketones and other dicarbonyl compounds was investigated. In the majority of cases the expected products of substitution of hydrogen atom with γ-hio(selen)acetylacetonate group were obtained. The products with two chelate groups were obtained using the lack of ketone. The unusual interaction of selenylchloride with acetylacetone

  图形摘要 摘要 研究了二氟化硼乙酰丙酮化物的亚磺酰氯和硒酰氯衍生物与酮、二酮和其他二羰基化合物的相互作用。在大多数情况下，获得了预期的氢原子被 γ-hio(selen) 乙酰丙酮基团取代的产物。使用缺乏酮获得具有两个螯合基团的产物。揭示了硒酰氯与乙酰丙酮和乙酰乙酸醚不寻常的相互作用。通过硼配合物的软水解获得在中心硫原子上带有酮基的乙酰丙酮衍生物。