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(acetylcyclopentadienyl)tricarbonylmanganese

中文名称
——
中文别名
——
英文名称
(acetylcyclopentadienyl)tricarbonylmanganese
英文别名
acetylcymantrene;Manganese,[(1,2,3,4,5-H)-1-acetyl-2,4-cyclopentadien-1-yl]tricarbonyl-
(acetylcyclopentadienyl)tricarbonylmanganese化学式
CAS
——
化学式
C10H7MnO4
mdl
——
分子量
246.101
InChiKey
AFYAHGVQHARYHX-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):
    1.16
  • 重原子数:
    15
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.1
  • 拓扑面积:
    20.1
  • 氢给体数:
    0
  • 氢受体数:
    4

反应信息

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文献信息

  • Synthesis and characterization of organometallic chalcones functionalized with a crown ether fragment. Spectroscopic and electrochemical behavior
    作者:Nicolás Agurto、Tamara Maldonado、Fernando Godoy、Alejandra Gómez、Carlos P. Silva、Jorge Pavez、Guillermo Ferraudi、Allen Oliver、A. Graham Lappin
    DOI:10.1016/j.jorganchem.2016.11.002
    日期:2017.1
    been synthesized. The complexes are characterized by IR spectroscopy, 1H and 13C NMR spectroscopies, elemental analyses, and HR-MS. The stereochemistry for the chalcone compounds was determined using the 1H and 13C NMR spectroscopy data, which indicated that they are isolated as a single isomer (E). In addition, the syntheses of the chalcone-imine derivatives are described, and they adopt an anti-(E,E)
    与大环片段[(η官能的有机金属配合物查耳酮5 -C 5 H ^ 4 C(O)CH CH -4-苯并-15-冠-5)MLN](二茂铁基,cyrhetrenyl和cymantrenyl)已经被合成。该复合物通过IR光谱,1 H和13 C NMR光谱,元素分析和HR-MS表征。查耳酮化合物的立体化学是使用1 H和13 C NMR光谱数据确定的,这表明它们是作为单一异构体(E)分离的。另外,描述了查耳酮-亚胺衍生物的合成,并且它们采用了抗-(E,E)通过固态X射线晶体结构确认溶液中的构象。报道了有机金属配合物的紫外可见和电化学行为。
  • Bioorganometallic derivatives of 4-hydrazino-benzenesulphonamide as carbonic anhydrase inhibitors: synthesis, characterisation and biological evaluation
    作者:Jeremie Brichet、Rodrigo Arancibia、Emanuela Berrino、Claudiu T. Supuran
    DOI:10.1080/14756366.2020.1724995
    日期:2020.1.1
    formyl/acetyl organometallic precursors with 4-hydrazino-benzenesulphonamide. All compounds were characterized by conventional spectroscopic techniques (infra-red, 1H and 13C NMR, mass spectrometry and elemental analysis). Biological evaluation as carbonic anhydrase (CA, EC 4.2.1.1) inhibitors agents was carried out using four human/h) isoforms, hCA I, II, IX and XII. The cytosolic isoforms hCA I and
    一系列生物有机金属腙,通式为 [(η5-C5H4)-C(R)=NN(H)-C6H4-4-SO2NH2}]MLn(MLn = Re(CO)3, Mn(CO )3, FeCp; R=H, CH3) 通过甲酰基/乙酰基有机金属前体与 4-肼基-苯磺酰胺反应制备。所有化合物均通过常规光谱技术(红外、1H 和 13C NMR、质谱和元素分析)进行表征。使用四种人/小时亚型hCA I、II、IX和XII进行作为碳酸酐酶(CA、EC 4.2.1.1)抑制剂的生物学评价。几乎所有衍生物都能有效抑制胞浆同工型 hCA I 和 II,抑制常数为 1.7-22.4 nM。对于肿瘤相关的跨膜亚型 hCA XII(KI 为 1.9-24.4 nM)也观察到了类似的效果。 hCA IX 对这些化合物的抑制不太敏感。这些 CAI 分子中存在生物有机金属或金属羰基部分,使其适合有趣的药理学应用,例如具有 CO 供给特性的化合物。
  • Synthesis, characterization and antibacterial studies of ferrocenyl and cymantrenyl hydrazone compounds
    作者:Vijaylakshmi Tirkey、Sasmita Mishra、Hirak R. Dash、Surajit Das、Bibhukalyan Prasad Nayak、Shaikh M. Mobin、Saurav Chatterjee
    DOI:10.1016/j.jorganchem.2013.02.020
    日期:2013.5
    [(η5-C5H5)Fe(η5-C5H4)C(CH3)N–N(H)C(O)–R}] (8, 9), [Fe(η5-C5H4)C(CH3)NN(H)C(O)R}2] (10, 12) (R = C6H4–OH, C5H4N), [(η5-C5H4)COCH3}Fe(η5-C5H4)C(CH3)NN(H)C(O)(C5H4N)}] (11) and [Fe(η5-C5H4)C(CH3)N–N(H)C(O)(C5H4N)}(η5-C5H4)C(CH3)NN(H)C(O)C6H4–OH}] (13) respectively. Antibacterial studies and electrochemical analysis were carried out for some of the compounds. Molecular structure determination was performed
    Cymantrenyl席夫碱的化合物[(CO)3的Mn (η 5 -C 5 H ^ 4)C(CH 3)N-N(H)C(O)R}](4 - 7)(R = C 6 H ^ 4 -OH ,C 5 H 4 N- p,C 6 H 5,C 5 H 4 N- o)是通过室温反应合成的,其结构表征是通过单晶X射线衍射研究进行的。的室温下反应的单和二乙酰二茂铁与水杨和异烟酰肼导致某些有机金属席夫碱化合物的形成含有单取代,二取代的和不对称取代的二茂铁基的片段,[(η 5 -C 5 H ^ 5)的Fe ( η 5 -C 5 H ^ 4)C(CH 3)N - N(H)C(O)-R}](8,9),[的Fe(η 5 -C 5 H ^ 4)C(CH 3)NN(H)C(O)R} 2 ](10,12)(R = C 6 H ^ 4 -OH,C 5 ħ 4 N),[(η 5 -C 5 H ^ 4)COCH 3 } 铁(η
  • SiCl<sub>4</sub>–ethanol as a trimerization agent for organometallics: convenient syntheses of the symmetrically substituted arenes 1,3,5-C<sub>6</sub>H<sub>3</sub>R<sub>3</sub> where R = (C<sub>5</sub>H<sub>4</sub>)Mn(CO)<sub>3</sub> and (C<sub>5</sub>H<sub>4</sub>)Fe(C<sub>5</sub>H<sub>5</sub>)
    作者:Hari K Gupta、Nada Reginato、Francis O Ogini、Stacey Brydges、Michael J McGlinchey
    DOI:10.1139/v02-152
    日期:2002.11.1

    Trimerization of acetylferrocene and of (acetylcyclopentadienyl)tricarbonyl-manganese proceeds efficiently in the presence of ethanol and tetrachlorosilane. The resulting 1,3,5-trisubstituted benzenes have been characterized by X-ray crystallography and compared with the structure of (1,3,5-triphenylbenzene)tris(tricarbonylchromium). The efficacy of EtOH–SiCl4 as a combined reagent for the trimerization of polycyclic ketones is also discussed. Finally, the synthesis and structure of [CpMn(CO)2]2(µ-C=CHPr), derived from the reaction of cymantrene with butyllithium and phenylacetyl chloride at room temperature, is described.Key words: ketone, condensation, cyclization, organometallics, arenes.

    乙醇和四氯硅烷存在的情况下,乙酰二茂铁和(乙酰环戊二烯基)三羰基锰的三聚化反应高效进行。通过X射线衍射对所得的1,3,5-三取代苯进行了表征,并与(1,3,5-三苯基苯)三(三羰基铬)的结构进行了比较。还讨论了EtOH-SiCl4作为多环酮三聚化的联合试剂的有效性。最后,描述了由环戊二烯基与丁基锂和苯乙酰氯在室温下反应得到的[CpMn(CO)2]2(µ-C=CHPr)的合成和结构。关键词:酮,缩合,环化,有机金属化合物,芳烃。
  • The Wittig reaction in the generation of organometallic compounds containing alkenes as side groups
    作者:Edward J. Miller、Carolyn A. Weigelt、Judith A. Serth、Rusydi Rusyid、Jeffery Brenner、Linda A. Luck、Michael Godlewski
    DOI:10.1016/0022-328x(92)83487-3
    日期:1992.11
    The Wittig reaction has been identified as a viable route to transition metal monomers. It has been used to synthesize η5-C5[C(CH3)CHR]}Mn(CO)3 [R  H (68% yield), -CH3 (60%), -CH2CH3 (51%), -CH2CH2CH3 (40%), -C6H5 (46%)] from acetylcymantrene and the appropriate phosphorane at room temperature. η5C5H4[C(CH3)CHR]}(η5-C5H5)Fe [R  -H (81%), -CH3 (77%). -CH2CH3 (36%), -CH2CH2CH3 (27%) have been prepared
    维蒂希反应已被认为是过渡金属单体的可行途径。它已被用于合成η 5 -C 5 [C(CH 3)CHR]}的Mn(CO)3 [RH(收率68%), - CH 3(60%), - CH 2 CH 3(51%),-CH 2 CH 2 CH 3(40%),-C 6 H 5(46%)],在室温下由乙酰基cy啶和适当的磷烷制成。η 5 Ç 5 ħ 4 [C(CH 3)CHR]}(η 5 -C 5 H ^ 5)的Fe [R-H(81%), - CH3(77%)。在室温下由乙酰基二茂铁和正膦制备-CH 2 CH 3(36%),-CH 2 CH 2 CH 3(27%)。[η 5 -C 5(CHCRR')H 4 ](η 5 -C 5 -H 5)的Fe [R,R'-H,H(79%); -CH 3,H(69%); -CH 2 CH 3,H(48%); -CH 2 CH 2 CH 3,H(49%); m
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