Ru2Cl4(1,8-bis(diphenylphosphinomethyl)naphthalene)2 | 218146-42-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: Ru2Cl4(1,8-bis(diphenylphosphinomethyl)naphthalene)2
• 英文别名: dichlororuthenium;[8-(diphenylphosphanylmethyl)naphthalen-1-yl]methyl-diphenylphosphane
• CAS: 218146-42-0
• 化学式: C₇₂H₆₀Cl₄P₄Ru₂
• 分子量: 1393.12
• InChiKey: IFURZHFFDQMZBA-UHFFFAOYSA-J

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：

  ruthenium(II) bis(triphenylphosphine) dichloride 、 dphpn 以 丙酮 为溶剂， 以80%的产率得到Ru2Cl4(1,8-bis(diphenylphosphinomethyl)naphthalene)2
  参考文献：
  名称：

  Synthesis and characterization of ruthenium complexes of 1,8-bis(diphenylphosphinomethyl)naphthalene (BDNA) and their catalytic hydrogenation reactions to α,β-unsaturated aldehydes

  摘要：

  A new ligand BDNA [1,8-bis(diphenylphosphinomethyl)naphthalene] and three ruthenium complexes containing the new ligand, Ru2Cl4(BDNA)(2) 1, RuHCl(CO)(PPh3)(BDNA) 2, and RuH2(CO)(PPh3)(BDNA) 3, have been synthesized. Their compositions and structures were characterized by P-31{H-1}-NMR, H-1-NMR, and elemental analysis. Molecular structure of 3 was also confirmed by single-crystal X-ray diffraction. The crystal belonged to the triclinic crystal system, P (1) over bar space group, a = 10.7450(7), b = 12.7100(7), c = 18.1390(13) Angstrom, alpha = 89.558(6), beta = 83.117(2), gamma = 80.859(5)degrees, V = 2428.0(3) Angstrom(3), and Z = 2. The hydrogenation results of citral and cinnamaldehyde revealed that complex 2 had good catalytic activity and complex 3 had the high selectivity for the hydrogenation of C=O bond in alpha,beta-unsaturated aldehydes to form the corresponding allylic alcohols. In the presence of complex 3, very high selectivities of 99.5 and 95.1% were obtained for the hydrogenation of the carbonyl group in citral and cinnamaldehyde, respectively. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(98)00889-4