1-benzyloxygermatrane | 88102-99-2

• 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: 1-benzyloxygermatrane
• 英文别名: 1-benzoyloxygermatrane；1-(Benzoyloxy)-2,8,9-trioxa-5-aza-1-germabicyclo[3.3.3]undecane；2,8,9-trioxa-5-aza-1-germabicyclo[3.3.3]undecan-1-yl benzoate
• CAS: 88102-99-2
• 化学式: C₁₃H₁₇GeNO₅
• 分子量: 339.872
• InChiKey: DRYAQQQXRSKGAH-UHFFFAOYSA-N

物化性质

• 熔点：
  264-266 °C
• 沸点：
  344.4±52.0 °C(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.66
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  57.2
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  三乙醇胺 以 5,5-dimethyl-1,3-cyclohexadiene 为溶剂， 反应 8.08h， 生成 1-benzyloxygermatrane
  参考文献：
  名称：

  1-Acyloxygermatranes

  摘要：

  A one-step method for the synthesis of 1-acyloxygermatranes RC(O)OGe(OCH2CH2)(3)N in the reaction of germanium dioxide with triethanolamine and a carboxylic acid was developed. 1-Acyloxygermatranes, including those containing biologically active acyloxy groups (R = 2-MeC6H4CH2OCH2, C6H5, 2-HOC6H4), were obtained with a 82-96.5% yield.

  DOI：

  10.1134/s1070363213080045

文献信息

• Reaction of 1-germatranol hydrate with carboxylic acids
  作者：V. P. Baryshok、N. T. Z. Le

  DOI：10.1134/s1070363215120154

  日期：2015.12

  Reaction of 1-germatranol hydrate with carboxylic acids RCOOH (R = ClCH2, PhCH=CH, Ph, 2-FC6H4, 3-BrC6H4, 3-HOC6H4, 3-EtOC6H4) in protic (CH3OH, iso-C5H11OH) and aprotic polar solvent (CH3CN) is studied. 1-Acyloxygermatranes RC(O)OGe(OCHin2}CHin2})in3}N are formed in yields from 11 to ~100 % depending on the nature of the acid, solvent, duration of the process and the method of its completion. The

  1- germatranol水合物与羧酸RCOOH反应（R = CLCH 2，的PhCH = CH，pH值，2-FC 6 H ^ 4，3-BRC 6 ħ 4，3-HOC 6 ħ 4，3-EtOC 6 H ^ 4）在质子惰性（CH 3 OH，iso -C 5 H 11 OH）和非质子极性溶剂（CH 3CN）被研究。根据酸的性质，溶剂，过程的持续时间和制备方法的不同，可以形成产率为11％至〜100％的1-酰氧基香叶烷RC（O）OGe（OCH in2} CH in2}）in3} N它的完成。该反应在乙腈中最有效。它的拓扑化学完成（在真空中加热反应残留物）增加了1-酰氧基香叶素的产率。
• 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：——
• 1-Acyloxygermatranes
  作者：V. P. Baryshok、L. N. Thuy Zang、M. G. Voronkov

  DOI：10.1134/s1070363213080045

  日期：2013.8

  A one-step method for the synthesis of 1-acyloxygermatranes RC(O)OGe(OCH2CH2)(3)N in the reaction of germanium dioxide with triethanolamine and a carboxylic acid was developed. 1-Acyloxygermatranes, including those containing biologically active acyloxy groups (R = 2-MeC6H4CH2OCH2, C6H5, 2-HOC6H4), were obtained with a 82-96.5% yield.