1-ethyl-5-methyl-1-galla-5-azacyclooctane | 124719-46-6

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1-ethyl-5-methyl-1-galla-5-azacyclooctane
• 英文别名: 5-Ethyl-1-methyl-1,5-azagallocane
• CAS: 124719-46-6
• 化学式: C₉H₂₀GaN
• 分子量: 211.987
• InChiKey: TWCLMDAPBNIQNE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.23
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  3,3'-methyliminobis(propylmagnesiumchloride) 以 乙醚 为溶剂， 生成 1-ethyl-5-methyl-1-galla-5-azacyclooctane
  参考文献：
  名称：

  Intramolekular stabilisierte gallium- und indiumorganyle: Synthese und röntgenstrukturanalyse repräsentativer 5-Methyl-1-galla(inda)-5-azacyclooktane

  摘要：

  The intramolecularly stabilized organogallium compounds ClGa(CH2CH2CH2)2NCH3 (1), RGa(CH2CH2CH2)2NCH3 (R = Pr, (i)Pr, Bu, (t)Bu, Ph, CH2SiMe3, (CH2)3NMe2, (CH2)3NEt2, CH2CHMeCH2NMe2, C6H4CH2NMe2, H, (4-14)) and the indium analogs ClIn(CH2CH2CH2)2NCH3 (16) and HIn(CH2CH2CH2)2NCH3 (17) have been synthesized from GaCl3 or InCl3 and bis[(3-chloromagnesio)propyl]methylamine and subsequent reaction with the appropriate Grignard reagents RMgX, with RLi or lithium hydride, respectively. HGa(CH2CH2CH2)2NCH3 (14) inserts CO2 yielding HO2CGa(CH2CH2CH2)2NCH3 (15). The H-1-, C-13-NMR and mass spectra of the new compounds as well as the X-ray crystal structure analyses of 1, 12, 14 and 15 are reported and discussed.

  DOI：

  10.1016/0022-328x(94)80189-4

文献信息

• Schumann, Herbert; Hartmann, Uwe; Wassermann, Wilfried, Chemische Berichte, 1991, vol. 124, p. 1113 - 1120
  作者：Schumann, Herbert、Hartmann, Uwe、Wassermann, Wilfried、Just, Oliver、Dietrich, Andreas、et al.

  DOI：——

  日期：——
• Intramolekular stabilisierte gallium- und indiumorganyle: Synthese und röntgenstrukturanalyse repräsentativer 5-Methyl-1-galla(inda)-5-azacyclooktane
  作者：Herbert Schumann、Oliver Just、Thomas D. Seuß、Roman Weimann

  DOI：10.1016/0022-328x(94)80189-4

  日期：1994.6

  The intramolecularly stabilized organogallium compounds ClGa(CH2CH2CH2)2NCH3 (1), RGa(CH2CH2CH2)2NCH3 (R = Pr, (i)Pr, Bu, (t)Bu, Ph, CH2SiMe3, (CH2)3NMe2, (CH2)3NEt2, CH2CHMeCH2NMe2, C6H4CH2NMe2, H, (4-14)) and the indium analogs ClIn(CH2CH2CH2)2NCH3 (16) and HIn(CH2CH2CH2)2NCH3 (17) have been synthesized from GaCl3 or InCl3 and bis[(3-chloromagnesio)propyl]methylamine and subsequent reaction with the appropriate Grignard reagents RMgX, with RLi or lithium hydride, respectively. HGa(CH2CH2CH2)2NCH3 (14) inserts CO2 yielding HO2CGa(CH2CH2CH2)2NCH3 (15). The H-1-, C-13-NMR and mass spectra of the new compounds as well as the X-ray crystal structure analyses of 1, 12, 14 and 15 are reported and discussed.