tert-Butyloxy-dimethyl-aluminium | 5898-74-8

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机过渡后金属化合物
• 英文名称: tert-Butyloxy-dimethyl-aluminium
• 英文别名: Dimethylalumanylium;2-methylpropan-2-olate；dimethylalumanylium;2-methylpropan-2-olate
• CAS: 5898-74-8
• 化学式: C₆H₁₅AlO
• 分子量: 130.166
• InChiKey: PUSCJUIYJNKDRK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.05
• 重原子数：
  8
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  [Cp*₂Yb(μ-AlMe₄)]₂ 、 tert-Butyloxy-dimethyl-aluminium 以 氘代甲苯 为溶剂， 以0%的产率得到
  参考文献：
  名称：

  Reaction of (C₅Me₅)₂Yb(ER)(NH₃) with Me₃Al. Formation of (C₅Me₅)₂Yb(AlMe₄) and [(C₅Me₅)₂Yb(ER)(AlMe₃)₂]₂

  摘要：

  Addition of 3 molar equiv of AlMe3 to (Me5C5)(2)Yb(ER)(NH3) gives two types of products depending on the identity of the ER group. When ER is OSiMe3 or TePh, the isolated metallocene is [(Me5C5)(2)Yb(Me4Al)](2), which exists as an equilibrium between monomeric and dimeric forms in toluene solution. When ER is OCMe3, SPh, S-p-tolyl, or SePh, the isolated metallocenes have the stoichiometry (Me5C5)(2)Yb(ER)(Me3Al)(2). The H-1 NMR spectra of these molecules show that several species are present in solution. The crystal structure of the S-p-tolyl derivative shows that two (Me5C5)(2)Yb fragments are bridged by two Me3Al(S-p-tolyl)AlMe3 units by way of nearly linear Yb...H3C-Al bonds.

  DOI：

  10.1021/om020472h
• 作为产物：
  描述：

  三甲基铝 、 叔丁醇 以 乙醚 、 正戊烷 为溶剂， 生成 tert-Butyloxy-dimethyl-aluminium
  参考文献：
  名称：

  Reaction of (C₅Me₅)₂Yb(ER)(NH₃) with Me₃Al. Formation of (C₅Me₅)₂Yb(AlMe₄) and [(C₅Me₅)₂Yb(ER)(AlMe₃)₂]₂

  摘要：

  Addition of 3 molar equiv of AlMe3 to (Me5C5)(2)Yb(ER)(NH3) gives two types of products depending on the identity of the ER group. When ER is OSiMe3 or TePh, the isolated metallocene is [(Me5C5)(2)Yb(Me4Al)](2), which exists as an equilibrium between monomeric and dimeric forms in toluene solution. When ER is OCMe3, SPh, S-p-tolyl, or SePh, the isolated metallocenes have the stoichiometry (Me5C5)(2)Yb(ER)(Me3Al)(2). The H-1 NMR spectra of these molecules show that several species are present in solution. The crystal structure of the S-p-tolyl derivative shows that two (Me5C5)(2)Yb fragments are bridged by two Me3Al(S-p-tolyl)AlMe3 units by way of nearly linear Yb...H3C-Al bonds.

  DOI：

  10.1021/om020472h

文献信息

• Reactions of benzopinacol with group 13 alkyl metals:
  作者：Wanda Ziemkowska、Anna Kubiak、Szymon Kucharski、Robert Woźniak、Romana Anulewicz-Ostrowska

  DOI：10.1016/j.poly.2006.11.032

  日期：2007.5

  monomeric complex tBuAl[OC(C6H5)2C(C6H5)2O](C4H8O) (3). Reactions of Me3Ga and Me3In with benzopinacol yielded trinuclear complexes Me5M3[OC(C6H5)2C(C6H5)2O]2 (4 (M = Ga), 5 (M = In)), isostructural to compound 1. In the presence of water and alcohols, compounds 4 and 5 underwent a decomposition reaction to benzopinacol and a mixture of metalloxanes and alkoxides. An unusual methylmethoxo indium benzopinacolate

  Me 5 Al 3 [OC（C 6 H 5）2 C（C 6 H 5）2 O] 2（1）与醇ROH（R ​​= Me，Et，t Bu）的摩尔比为1：1的反应化合物Me 2 Al 2 [OC（C 6 H 5）2 C（C 6 H 5）2 O] 2（C 4 H 8 O）（2）和甲基铝醇盐的混合物。醇充当正式从化合物1中消除Me 3 Al分子（作为甲基铝醇盐）的因素。t Bu 3 Al与等摩尔量的苯并频哪醇反应形成单体络合物t BuAl [OC（C 6 H 5）2 C（C 6 H 5）2 O]（C 4 H 8 O）（3）。Me 3 Ga和Me 3 In与苯并频哪醇的反应生成三核配合物Me 5 M 3 [OC（C6 H 5）2 C（C 6 H 5）2 O] 2（4（M = Ga），5（M = In）），与化合物1同构。在水和醇的存在下，化合物4和5进行分解反应成苯并频哪醇以及金属氧烷和醇盐的混合物。一
• Reaction of (C₅Me₅)₂Yb(ER)(NH₃) with Me₃Al. Formation of (C₅Me₅)₂Yb(AlMe₄) and [(C₅Me₅)₂Yb(ER)(AlMe₃)₂]₂
  作者：David J. Berg、Richard A. Andersen

  DOI：10.1021/om020472h

  日期：2003.2.1

  Addition of 3 molar equiv of AlMe3 to (Me5C5)(2)Yb(ER)(NH3) gives two types of products depending on the identity of the ER group. When ER is OSiMe3 or TePh, the isolated metallocene is [(Me5C5)(2)Yb(Me4Al)](2), which exists as an equilibrium between monomeric and dimeric forms in toluene solution. When ER is OCMe3, SPh, S-p-tolyl, or SePh, the isolated metallocenes have the stoichiometry (Me5C5)(2)Yb(ER)(Me3Al)(2). The H-1 NMR spectra of these molecules show that several species are present in solution. The crystal structure of the S-p-tolyl derivative shows that two (Me5C5)(2)Yb fragments are bridged by two Me3Al(S-p-tolyl)AlMe3 units by way of nearly linear Yb...H3C-Al bonds.