HC[C(Me)N(2,6-iPr2C6H3)]2Al(Cl)NiPr2 | 1018986-29-2

• 英文名称: HC[C(Me)N(2,6-iPr2C6H3)]2Al(Cl)NiPr2
• CAS: 1018986-29-2
• 化学式: C₃₅H₅₅AlClN₃
• 分子量: 580.276
• InChiKey: JTWUQQHHNVMINH-KSWNCPITSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
  None
• 氢给体数：
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• 氢受体数：
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反应信息

• 作为反应物：
  描述：

  HC[C(Me)N(2,6-iPr2C6H3)]2Al(Cl)NiPr2 、 甲基锂 以 甲苯 为溶剂， 以62%的产率得到HC[C(Me)N(2,6-iPr2C6H3)]2Al(Me)NiPr2
  参考文献：
  名称：

  Synthesis, Characterization, and Reaction of Aluminum Halide Amides Supported by a Bulky β-Diketiminato Ligand

  摘要：

  Monomeric aluminum chloride amides with the general formula LAI(CI)NR2 (1, R = Me; 2, R = iPr; 3, R = SiMe3; L = HC[C(Me)N(Ar)](2); Ar = 2,6-iPr(2)C(6)H(3)) were prepared by selected routes. Treatment of LAIBr(2) (4) and LAII(2) with LiNMe2 yielded LAI(Br)NMe2 (5) and LAI(I)NMe2 (6), respectively. The alkylation of 1 and 2 with MeLi gave the corresponding methylated compounds LAI(Me)NR2 (7, R = Me; 8, R = iPr); however, no reaction of 3 with MeLi was observed because of steric hindrance. Subsequent fluorination of 1-3 afforded LAI(F)NR2 (9, R = Me; 10, R = iPr; 11, R = SiMe3)- Compounds 1-11 were characterized by multinuclear NMR, electron impact mass spectrometry, and IR. The constitution of compounds 1-3 was confirmed by single-crystal X-ray diffraction studies.

  DOI：

  10.1021/ic701896r
• 作为产物：
  描述：

  三氯化铝 、 (2-((2,6-diisopropylphenyl)amino)-4-((2,6-diisopropylphenyl)imino)pent-2-ene)Li*OEt2 、 lithium diisopropyl amide 以 甲苯 为溶剂， 以27%的产率得到HC[C(Me)N(2,6-iPr2C6H3)]2Al(Cl)NiPr2
  参考文献：
  名称：

  Synthesis, Characterization, and Reaction of Aluminum Halide Amides Supported by a Bulky β-Diketiminato Ligand

  摘要：

  Monomeric aluminum chloride amides with the general formula LAI(CI)NR2 (1, R = Me; 2, R = iPr; 3, R = SiMe3; L = HC[C(Me)N(Ar)](2); Ar = 2,6-iPr(2)C(6)H(3)) were prepared by selected routes. Treatment of LAIBr(2) (4) and LAII(2) with LiNMe2 yielded LAI(Br)NMe2 (5) and LAI(I)NMe2 (6), respectively. The alkylation of 1 and 2 with MeLi gave the corresponding methylated compounds LAI(Me)NR2 (7, R = Me; 8, R = iPr); however, no reaction of 3 with MeLi was observed because of steric hindrance. Subsequent fluorination of 1-3 afforded LAI(F)NR2 (9, R = Me; 10, R = iPr; 11, R = SiMe3)- Compounds 1-11 were characterized by multinuclear NMR, electron impact mass spectrometry, and IR. The constitution of compounds 1-3 was confirmed by single-crystal X-ray diffraction studies.

  DOI：

  10.1021/ic701896r