[Ru(CO)2(C6D5)(η5-pentamethylcyclopentadienyl)] | 1053253-44-3

• 英文名称: [Ru(CO)2(C6D5)(η5-pentamethylcyclopentadienyl)]
• CAS: 1053253-44-3
• 化学式: C₁₈H₂₀O₂Ru
• 分子量: 374.386
• InChiKey: HYYZTBFVCVARCR-XISYSUQGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  Ru(η5-C5Me5)(CO)2CH3 、 氘代苯 以 氘代苯 为溶剂， 生成 [Ru(CO)2(C6D5)(η5-pentamethylcyclopentadienyl)]
  参考文献：
  名称：

  C–H activation of benzene with Cp∗Ru(CO)2CH3

  摘要：

  Irradiation of Cp*Ru(CO)(2)CH(3) (1) in C(6)D(6) at room temperature yields Cp*Ru(CO)(2)C(6)D(5) and CH(3)D (where Cp* = n(5)-C(5)Me(5)). Cp*Ru(CO)(2)CD(3) (2) has also been prepared and similar irradiation in C(6)H(6) yields Cp*Ru(CO)(2)C(6)H(5) (3) and CD(3)H. This latter reaction confirms that it is the methyl group bonded to ruthenium that is involved in the C-H activation process and not the methyl groups on the Cp* ligand system. The compound Cp*Ru(CO)(2)C(6)H(5) (3) has been prepared for the first time in good yield by the reaction of Cp*Ru(CO)(2)Br with NaBPh(4). X-ray crystal structures of both Cp*Ru(CO)(2)CH(3) (1) and Cp*Ru(CO)(2)C(6)H(5) (3) have been determined and the results are reported and discussed. (c) 2008 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2008.05.013