1-fluorogermatrane | 88103-00-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1-fluorogermatrane
• 英文别名: 1-Fluoro-2,8,9-trioxa-5-aza-1-germabicyclo[3.3.3]undecane
• CAS: 88103-00-8
• 化学式: C₆H₁₂FGeNO₃
• 分子量: 237.755
• InChiKey: QFKNLAPZGPSYQX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.23
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  30.9
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  氟化铵 、 1-羟基-2,8,9-三氧杂-5-氮杂-1-锗杂双环(3.3.3)十一烷 以 not given 为溶剂， 生成 1-fluorogermatrane
  参考文献：
  名称：

  New method of synthesis 1-halogermatranes, germatranyl esters of H-O acids, and their stereoelectronic structure

  摘要：

  A fundamentally new method for the synthesis of 1-halogermatranes and germatranyl esters of oxygen-containing acids has been developed. Using this method germatranes XGe(OCH(2)CH(2))(3)N (X = Hal, ClO(4))were synthesized, their elemental analysis was determined, and their stereoelectronic structure was studied by the methods of multinuclear NMR, mass spectrometry, and IR spectroscopy. The obtained data correlate with the results of quantum chemical calculations.

  DOI：

  10.1134/s1070363208120086

文献信息

• GAR, T. K.;XROMOVA, N. YU.;TANDURA, S. N.;MIRONOV, V. F., ZH. OBSHCH. XIMII, 1983, 53, N 8, 1800-1807
  作者：GAR, T. K.、XROMOVA, N. YU.、TANDURA, S. N.、MIRONOV, V. F.

  DOI：——

  日期：——
• New method of synthesis 1-halogermatranes, germatranyl esters of H-O acids, and their stereoelectronic structure
  作者：M. G. Voronkov、T. A. Kochina、D. V. Vrazhnov、G. S. Samokhin、A. I. Albanov、T. N. Aksamentova、L. V. Klyba、N. N. Chipanina

  DOI：10.1134/s1070363208120086

  日期：2008.12

  A fundamentally new method for the synthesis of 1-halogermatranes and germatranyl esters of oxygen-containing acids has been developed. Using this method germatranes XGe(OCH(2)CH(2))(3)N (X = Hal, ClO(4))were synthesized, their elemental analysis was determined, and their stereoelectronic structure was studied by the methods of multinuclear NMR, mass spectrometry, and IR spectroscopy. The obtained data correlate with the results of quantum chemical calculations.