[Mn(bp)(NCS)0.9(NO3)0.1(CH3OH)]*CH3OH | 1584642-56-7

• 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: [Mn(bp)(NCS)0.9(NO3)0.1(CH3OH)]*CH3OH
• 英文别名: [Mn(bp)(NCS)_0.9(NO₃)_0.1(CH₃OH)]*CH₃OH
• CAS: 1584642-56-7
• 化学式: CH₄O*C₃₈H₅₄MnN₃O₃S
• 分子量: 719.911
• InChiKey: OOUSVVSFYMXEHY-UHFFFAOYSA-L

计算性质

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

反应信息

• 作为产物：
  描述：

  manganese (II) nitrate tetrahydrate 、 potassium thioacyanate 、 N-(2-pyridylmethyl)-N,N-bis(2-hydroxy-3,5-di-tert-butylbenzyl)amine 以 甲醇 为溶剂， 反应 12.0h， 以70%的产率得到[Mn(bp)(NCS)0.9(NO3)0.1(CH3OH)]*CH3OH
  参考文献：
  名称：

  Synthesis, characterization and catalytic reactivity of Mn(III) complexes with a scorpion-like bis(phenolate) ligand: Selective oxidation of primary alcohols to aldehydes

  摘要：

  Two new mononuclear complexes of manganese(III), [Mn(bp)(N-3)(CH3OH)]center dot 0.5CH(3)OH (1) and [Mn(bp)(NCS)(0.9)(NO3)(0.1)(CH3OH)]center dot CH3OH (2), have been synthesized, where H2bp is 6,6'-(pyridin-2ylmethylazanediyl)bis(methylene)bis(2,4-di-tert-butylphenol). The complexes were characterized by elemental analyses and spectroscopic methods, and fully characterized by X-ray diffraction analysis. Single-crystal X-ray diffraction structure analysis of the complexes revealed that the manganese atom is octahedrally coordinated, where the bis(phenolate) ligand (bp(2-)) is N(2)0(2)-bonded to the Mn(III) center in a tetradentate dinegative fashion. The catalytic potential of these complexes has been tested for the oxidation of primary alcohols using H(2)0(2) as the oxidant. The effects of various parameters, including the molar ratio of oxidant to substrate, the temperature and the solvent, have been studied. On comparing the catalytic activity of 1 and 2, catalyst 2 showed the most powerful activity in the oxidation of alcohols. Excellent conversions have been obtained for the oxidation of benzyl alcohols containing electrondonating groups at the para-position. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2014.01.020
• 作为试剂：
  描述：

  水杨醇 在 [Mn(bp)(NCS)0.9(NO3)0.1(CH3OH)]*CH3OH 、 双氧水 作用下， 以 乙腈 为溶剂， 反应 4.0h， 以49%的产率得到水杨醛
  参考文献：
  名称：

  Synthesis, characterization and catalytic reactivity of Mn(III) complexes with a scorpion-like bis(phenolate) ligand: Selective oxidation of primary alcohols to aldehydes

  摘要：

  Two new mononuclear complexes of manganese(III), [Mn(bp)(N-3)(CH3OH)]center dot 0.5CH(3)OH (1) and [Mn(bp)(NCS)(0.9)(NO3)(0.1)(CH3OH)]center dot CH3OH (2), have been synthesized, where H2bp is 6,6'-(pyridin-2ylmethylazanediyl)bis(methylene)bis(2,4-di-tert-butylphenol). The complexes were characterized by elemental analyses and spectroscopic methods, and fully characterized by X-ray diffraction analysis. Single-crystal X-ray diffraction structure analysis of the complexes revealed that the manganese atom is octahedrally coordinated, where the bis(phenolate) ligand (bp(2-)) is N(2)0(2)-bonded to the Mn(III) center in a tetradentate dinegative fashion. The catalytic potential of these complexes has been tested for the oxidation of primary alcohols using H(2)0(2) as the oxidant. The effects of various parameters, including the molar ratio of oxidant to substrate, the temperature and the solvent, have been studied. On comparing the catalytic activity of 1 and 2, catalyst 2 showed the most powerful activity in the oxidation of alcohols. Excellent conversions have been obtained for the oxidation of benzyl alcohols containing electrondonating groups at the para-position. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2014.01.020