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1-ferrocenyl-3-ruthenocenylpropane-1,3-dione | 436141-76-3

中文名称
——
中文别名
——
英文名称
1-ferrocenyl-3-ruthenocenylpropane-1,3-dione
英文别名
ferrocenoylruthenocenoylmethane
1-ferrocenyl-3-ruthenocenylpropane-1,3-dione化学式
CAS
436141-76-3
化学式
C23H20FeO2Ru
mdl
——
分子量
485.328
InChiKey
BAWGFQLSEABMRU-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

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

  • 作为反应物:
    描述:
    1-ferrocenyl-3-ruthenocenylpropane-1,3-dione 以 neat (no solvent, solid phase) 为溶剂, 生成 1-ferrocenyl-3-ruthenocenylpropane-1,3-dione
    参考文献:
    名称:
    含钌茂金属的β-二酮:合成,p K a ′值,酮-烯醇异构化动力学和电化学方面
    摘要:
    在受阻碱二异丙基氨基锂的影响下,将乙酰基钌茂金属与适当的甲酯RCOOMe进行克莱森缩合,得到β-二酮(RcCOCH 2 COR)1-钌茂金属-4,4,4-三氟丁烷-1,3-二酮(钌烷基乙酰基三氟丙酮,1,R = CF 3 ; p K a '= 7.36±0.03),1-钌烯基丁烷-1,3-二酮(钌乙基乙酰基丙酮,2,R = CH 3 ; p K a '= 10.22±0.01),1-苯基-3-钌烯基丙烷-1,3-二酮(苯甲酰钌烯基甲烷,3,R = C 6 H 5 ; p K a′= 11.31±0.03),1-二茂铁基-3-钌烯基丙烷-1,3-二酮(二茂铁基钌烯基乙酰基甲烷,4,R = Fc =(C 5 H 5)Fe(C 5 H 4)=二茂铁基; p K a '=大约12.8)和1,3-十二碳烯基丙烷-1,3-二酮(十二碳烯基甲烷,5,R = Rc =(C 5 H 5)Ru(C 5 H 4)=钌烯基;
    DOI:
    10.1021/om700609z
  • 作为产物:
    描述:
    1-ferrocenyl-3-ruthenocenylpropane-1,3-dione 以 氘代氯仿 为溶剂, 生成 1-ferrocenyl-3-ruthenocenylpropane-1,3-dione
    参考文献:
    名称:
    含钌茂金属的β-二酮:合成,p K a ′值,酮-烯醇异构化动力学和电化学方面
    摘要:
    在受阻碱二异丙基氨基锂的影响下,将乙酰基钌茂金属与适当的甲酯RCOOMe进行克莱森缩合,得到β-二酮(RcCOCH 2 COR)1-钌茂金属-4,4,4-三氟丁烷-1,3-二酮(钌烷基乙酰基三氟丙酮,1,R = CF 3 ; p K a '= 7.36±0.03),1-钌烯基丁烷-1,3-二酮(钌乙基乙酰基丙酮,2,R = CH 3 ; p K a '= 10.22±0.01),1-苯基-3-钌烯基丙烷-1,3-二酮(苯甲酰钌烯基甲烷,3,R = C 6 H 5 ; p K a′= 11.31±0.03),1-二茂铁基-3-钌烯基丙烷-1,3-二酮(二茂铁基钌烯基乙酰基甲烷,4,R = Fc =(C 5 H 5)Fe(C 5 H 4)=二茂铁基; p K a '=大约12.8)和1,3-十二碳烯基丙烷-1,3-二酮(十二碳烯基甲烷,5,R = Rc =(C 5 H 5)Ru(C 5 H 4)=钌烯基;
    DOI:
    10.1021/om700609z
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文献信息

  • Synthesis by ligand exchange and electrochemistry of ruthenocenyl-containing β-diketonato complexes of titanocene. Structure of [TiCp 2 (RcCOCHCOCH 3 )][ClO 4 ]
    作者:Elizabeth Erasmus、Alfred J. Muller、Uwe Siegert、Jannie C. Swarts
    DOI:10.1016/j.jorganchem.2016.05.011
    日期:2016.10
    A new synthetic route involving ligand exchange towards a series of ruthenocenyl-containing β-diketonato titanocene complexes of the type [TiIV(C5H5)2(RcCOCHCOR)][ClO4] with Rc = RuII(C5H5)(C5H4) and R = C10F21 (1), CF3 (2), C6F5 (3), C10H21 (4), CH3 (5), Rc (6) and Fc = FeII(C5H5)(C5H4) (7) are described. The complex [TiIV(C5H5)2(RcCOCHCOCH3)][ClO4], 5, (Z = 4) crystallised in the monoclinic space
    一种新的合成途径,涉及将配体交换为一系列[Ti IV(C 5 H 5)2(RcCOCHCOR)] [ClO 4 ]类型的含烯基的β-二酮属茂配合物,其中Rc = Ru II(C 5 H 5)(C 5 H 4)且R = C 10 F 21(1),CF 3(2),C 6 F 5(3),C 10 H 21(4),CH 3(5),描述了Rc(6)和Fc = Fe II(C 5 H 5)(C 5 H 4)(7)。在单斜空间群P2 1 / n中结晶的络合物[Ti IV(C 5 H 5)2(RcCOCHCOCH 3)] [ClO 4 ],5(Z = 4)结晶。在CH 2 Cl 2 /0.1 M [NBu 4 ] [B(C 6 F 5)4 ]中的循环伏安电化学研究表明,Ti的单电子转移氧化还原过程III / Ti IV和Rc / Rc +对表现出不可逆的电化学行为。在CH 3 CN / 0.1 M [N(n
  • Solvent and electrolyte effects in enhancing the identification of intramolecular electronic communication in a multi redox-active diruthenium tetraferrocenoate complex, a triple-sandwiched dicadmium phthalocyanine and a ruthenocene-containing β-diketone
    作者:Henno J. Gericke、Nicola I. Barnard、Elizabeth Erasmus、Jannie C. Swarts、Michael J. Cook、Manuel A.S. Aquino
    DOI:10.1016/j.ica.2010.03.031
    日期:2010.6
    Enhanced electrochemical resolution of anodic processes is possible in the presence of [N(Bu-n)(4)][B(C6F5)(4)], 1, as supporting electrolyte over that obtained in the presence of [N(Bu-n)(4)][PF6]. By changing the anion of the supporting electrolyte to a salt having [B(C6F5)(4)], anions, electrochemical processes of especially cationic analytes can benefit. Thus, the redox chemistry of 0.5 mmol dm(-3) solutions of [Ru-2(mu-FcCOO)(4)center dot(CH3CH2OH)(2)][PF6], 2, Fc = ferrocenyl, in CH2Cl2/[N(Bu-n)(4)][B(C6F5)(4)] were found to involve four well-resolved ferrocenyl- based electrochemical reversible redox processes as well as reduction of Ru-III-Ru-II. At 1.0 mmol dm(-3) concentrations of 2, or in the presence of [N(Bu-n)(4)][PF6], the four ferrocenyl processes coalesced into only two waves as a result of (Fc(+))center dot center dot center dot(PF6-) ion paring. Seventeen of the possible 18 one-electron transfer processes of the biscadmium trisphthalocyaninato complex [Cd-2Pc(C6H13)(8)}(3)], 3, could be observed in THF/[N(Bu-n)(4)][B(C6F5)(4)], but the electrochemical window of CH2Cl2/[N(Bu-n)(4)][B(C6F5)(4)] only allowed detection of 15 of these processes. Although reduction processes were unaffected, THF solvation leading to species such as (3(n+))(THF)(x) with 1 <= n <= 4 and x >= 1 as well as ion pair formation of the type (3n+)center dot center dot center dot(PF6-) prevented good resolution of oxidation processes. The CH2Cl2/[N(Bu-n)(4)][B(C6F5)(4)] system also allowed detection of reversible one- electron transfer ferrocenyl (Fc/Fc(+)) and ruthenocenyl-based (Rc/Rc(+)) processes for both enol and keto isomers of the beta-diketone FcC-OCH(2)CORc, 4, Rc = ruthenocenyl. In CH3CN/[N(Bu-n)(4)][PF6], the ruthenocenyl moiety was oxidised to a Ru-IV species. (C) 2010 Elsevier B.V. All rights reserved.
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