[(p-cymene)Ru(C7H8NO2)Cl] | 252573-94-7

• 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: [(p-cymene)Ru(C7H8NO2)Cl]
• 英文别名: chlorido[3-hydroxy-1,2-dimethyl-4(1H)-pyridinone](η6-p-cymene)ruthenium(II)；chlorido[3-hydroxy-1,2-dimethyl-4(1H)-pyridinone](cym)ruthenium(II)；chlororuthenium(1+);1,2-dimethyl-4-oxopyridin-3-olate;1-methyl-4-propan-2-ylbenzene
• CAS: 252573-94-7
• 化学式: C₁₇H₂₂ClNO₂Ru
• 分子量: 408.89
• InChiKey: CKJNUXMOGBCONQ-UHFFFAOYSA-L

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：
  None

反应信息

• 作为反应物：
  描述：

  [(p-cymene)Ru(C7H8NO2)Cl] 、 正丁胺 以 甲醇 为溶剂， 以92%的产率得到[(p-cymene)Ru(C7H8NO2)(n-butylamine)]Cl
  参考文献：
  名称：

  Halfsandwich complexes of ruthenium(II), rhodium(III) and iridium(III) with N-substituted 3-hydroxy-2-methyl-4-pyridone ligands

  摘要：

  The synthesis and characterization of (p-cymene)Ru-II, Cp*Rh-III and Cp*Ir-III complexes with N-alkyl and N-aryl substituted 3-hydroxy-2-methyl-4-pyridone ligands is reported. All compounds display an unusually high solubility in water. With the chiral ligand N-(o-C6H4CO2Me)-3-hydroxy-2-methyl-4-pyridone two isomers were obtained but no diastereoselectivity was observed. The structure of [(p-cymene)Ru(C9H12NO2)Cl] (2) was determined by single crystal X-ray diffraction. Reactions of [p-cymene) Ru(C7H8NO2)Cl] (1) with n-butylamine and triphenylphosphine were shown to result in substitution of the chloride ligand. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0020-1693(99)00280-7
• 作为产物：
  描述：

  1,2-二甲基-3-羟基-4-吡啶酮 、 [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂ 在 NaOMe 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 以85%的产率得到[(p-cymene)Ru(C7H8NO2)Cl]
  参考文献：
  名称：

  Halfsandwich complexes of ruthenium(II), rhodium(III) and iridium(III) with N-substituted 3-hydroxy-2-methyl-4-pyridone ligands

  摘要：

  The synthesis and characterization of (p-cymene)Ru-II, Cp*Rh-III and Cp*Ir-III complexes with N-alkyl and N-aryl substituted 3-hydroxy-2-methyl-4-pyridone ligands is reported. All compounds display an unusually high solubility in water. With the chiral ligand N-(o-C6H4CO2Me)-3-hydroxy-2-methyl-4-pyridone two isomers were obtained but no diastereoselectivity was observed. The structure of [(p-cymene)Ru(C9H12NO2)Cl] (2) was determined by single crystal X-ray diffraction. Reactions of [p-cymene) Ru(C7H8NO2)Cl] (1) with n-butylamine and triphenylphosphine were shown to result in substitution of the chloride ligand. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0020-1693(99)00280-7

文献信息

• Cationic Ru(η ⁶ ‐ <i>p</i> ‐cymene) Complexes of 3‐Hydroxy‐4‐pyr(id)ones – Lipophilic Triphenylphosphine as Co‐Ligand Is Key to Highly Stable and Cytotoxic Anticancer Agents
  作者：Shahida Parveen、Muhammad Hanif、Sanam Movassaghi、Matthew P. Sullivan、Mario Kubanik、Muhammad Ashraf Shaheen、Tilo Söhnel、Stephen M. F. Jamieson、Christian G. Hartinger

  DOI：10.1002/ejic.201601163

  日期：2017.3.27

  Ru(arene)(3-hydroxy-4(1H)-pyr(id)one)Cl complexes are known to be converted in aqueous solution to trishydroxido-bridged dinuclear Ru(arene) compounds. In an attempt to obtain anticancer Ru(arene) complexes of 3-hydroxy-4(1H)-pyr(id)one ligands that are stable in aqueous solution, triphenylphosphine (PPh3) and 1,3,5-triaza-7-phoshatricyclo[3.3.1.1]decane (pta) were introduced as co-ligands instead

  已知 Ru(芳烃)(3-羟基-4(1H)-pyr(id)one)Cl 配合物在水溶液中转化为三羟基桥连的双核 Ru(芳烃) 化合物。为了获得在水溶液中稳定的 3-羟基-4(1H)-吡(id)酮配体的抗癌 Ru(芳烃)配合物，三苯基膦 (PPh3) 和 1,3,5-triaza-7-phoshatricyclo [3.3.1.1]癸烷 (pta) 作为共配体而不是氯配体引入。这导致了一系列使用标准方法和 X 射线衍射分析表征的阳离子配合物。发现 pta 复合物在水溶液中高度稳定长达 120 小时。虽然它们在 l-组氨酸存在下不反应，但 l-半胱氨酸诱导 3-羟基-4(1H)-pyr(id)one 配体从 Ru 中心裂解。