4-pyridinecarboxylic acid diethylene glycol diester | 850008-93-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 4-pyridinecarboxylic acid diethylene glycol diester
• 英文别名: 2-[2-(Pyridine-4-carbonyloxy)ethoxy]ethyl pyridine-4-carboxylate；2-[2-(pyridine-4-carbonyloxy)ethoxy]ethyl pyridine-4-carboxylate
• CAS: 850008-93-4
• 化学式: C₁₆H₁₆N₂O₅
• 分子量: 316.313
• InChiKey: BSSQGOPLXUFPTH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  23
• 可旋转键数：
  10
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  87.6
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  五羰基溴化锰(I) 、 4-pyridinecarboxylic acid diethylene glycol diester 以 二氯甲烷 为溶剂， 反应 48.0h， 以83%的产率得到[Mn(CO)₃Br(μ-(4-pyridinecarboxylic acid diethyleneglycol diester))]₂
  参考文献：
  名称：

  Synthesis and characterization of manganese(I) and rhenium(I) based M2L2- and M2(µ-Br)2L-type diethyleneglycol decorated ester functionalized metallacycles

  摘要：

  M2L2-type metallacycles [M(CO)(3)Br(mu-pcadgd)](2) (1, M = Mn; 2, M = Re) were prepared by the reaction of equimolar amounts of M(CO)(5)Br and 4-pyridinecarboxylic acid diethyleneglycol diester (L = pcadgd). On the other hand, polyether spacer containing bromido-bridged M-2(mu-Br)(2)L-type metallacycles [M-2(CO)(6)(mu-Br)(2)(mu-pcadgd)] (3, M = Mn; 4, M = Re) were obtained by treating two equivalents of M(CO)(5)Br with one equivalent of 4-pyridinecarboxylic acid diethyleneglycol diester (pcadgd). Compounds 1-4 were characterized using elemental analyses, NMR, IR and UV-Vis absorption spectroscopic techniques. Formation of 1-4 was ascertained by ESI-mass spectrometry, while the structural elucidation of bromido-bridged compound 3 was carried out by single-crystal X-ray diffraction analysis. This research work comprises the first Mn(I)-based polyether spacer containing dinuclear metallacycles with/without a bromido-bridge, along with their Re counterparts. The metallacycles 1-4 were obtained in a single-step directly from M(CO)(5)Br via a two precursor self-assembly. (C) 2017 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2017.11.042
• 作为产物：
  描述：

  [{RuCl₂(η⁶-p-cym)}₂μ-(4-py)COO(CH₂CH₂O)₂CO(4-py)-κN,κN'] 、 二甲基亚砜 生成 (η6-p-cymene)dimethylsulfoxideruthenium(II) dichloride 、 4-pyridinecarboxylic acid diethylene glycol diester
  参考文献：
  名称：

  具有双（烟酸酯）-和双（异烟酸酯）-聚乙二醇酯配体的双核双氯氰（η6-对-cymene）钌（II）配合物

  摘要：

  中性双核钌络合物1，2，3，4，5，6，7，8通式[{的RuCl 2（η 6 - p -cym）} 2  μ-（N ∩ N）]（N ∩ N =双（烟酸酯）和双（异烟酸酯）聚乙二醇酯：（3-py）COO（CH 2 CH 2 O）n CO（3-py）和（4-py）COO（CH 2 CH 2 O）n CO（4-py），n = 1–4），以及单核[RuCl 2（η 6 - p -cym）（（3-吡啶）COO（CH 2 CH 2 OCH 3） - κN）]，复杂9，进行了合成，并使用元素分析和电喷雾电离高分辨率质谱表征，红外，1 1 H NMR和13 C NMR光谱。研究了在二甲基亚砜存在下双核配合物的稳定性。此外，使用1 H NMR光谱监测包含桥接吡啶基双齿配体的阳离子络合物的形成。配体前体，烟碱的聚乙二醇酯（L1  ·2HCl– L4  ·2HCl和L9  ·盐酸盐）和异烟酸二盐酸盐（L5  ·2HCl-

  DOI：

  10.1002/aoc.3238

文献信息

• Oxamidato pillared heteroligated dirhenium(I) metallacrown ethers: Synthesis, spectroscopic and structural characterization
  作者：Buthanapalli Ramakrishna、Chowan Ashok Kumar、Tevendriya J. Logesh、Bala. Manimaran

  DOI：10.1016/j.jorganchem.2016.11.030

  日期：2017.1

  Oxidative addition of oxamide ligands (H2L = N,N′-diphenyloxamide, and N,N′-dibenzyloxamide) to rhenium carbonyl (Re2(CO)10) in the presence of flexible ditopic pyridyl ligands having polyether spacer (L′ = 4-pyridinecarboxylic acid diethylene glycol diester and 4-pyridinecarboxylic acid tetraethylene glycol diester) afforded dirhenium(I) metallacrown ethers of general formula [(CO)3Re(μ-L)(μ-L′)Re(CO)3]

  在具有聚醚间隔基的灵活的对位吡啶基配位基存在下，将乙酰胺配体（H 2 L =  N，N'-二苯基乙酰胺和N，N'-二苄基乙酰胺）氧化加成到羰基rh （Re 2（CO）10）上= 4-吡啶羧酸二乙二醇二酯和4-吡啶羧酸四甘醇二酯），得到dirhenium（I）metallacrown通式醚[（CO）3的Re（μ-L）（μ-L'）的Re（CO）3 ] （1 - 3）。的FAC -Re（CO）3在溶剂热条件下，通过四组分杂配体自组装，在一锅反应中获得了基于核的双核金属环。化合物1 - 3使用元素分析，IR，UV-Vis和NMR光谱技术进行表征。通过ESI质量分析确定1的形成，而使用单晶X射线衍射法进行2和3的结构阐明。结构研究揭示了一个双核骨架，其中两个fac -Re（CO）3单元通过桥联的ligand酰胺配体通过ON∩NO双螯合连接在一起，并通过Re以正交方式进行N配位。
• Concomitant crystallization of two polymorphs—a ring and a helix: concentration effect on supramolecular isomerism
  作者：Katharina M. Fromm、Jorge L. Sagué Doimeadios、Adeline Y. Robin

  DOI：10.1039/b506389b

  日期：——

  For the first time in Ag coordination chemistry, two supramolecular isomers, a ring and a helix, are isolated from the same mother liquor as a result of concentration effects.

  在银配位化学中，首次通过浓度效应从同一母液中分离出两种超分子异构体，即环和螺旋。
• Self-assembly of manganese(<scp>i</scp>) based thiolato bridged dinuclear metallacycles: synthesis, characterization, cytotoxicity evaluation and CO-releasing studies
  作者：Udit Kumar、Shilpa Jose、Dhanaraj Divya、Pitchavel Vidhyapriya、Natarajan Sakthivel、Bala. Manimaran

  DOI：10.1039/c8nj06271d

  日期：——

  Manganese(i) based thiolato bridged dinuclear metallacycles were assessed as anticancer agents along with myoglobin assay for CO-releasing studies.

  基于硫代桥联的二核锰配合物被评估为抗癌药物，并与肌红蛋白测定一起用于CO释放研究。
• ANTIMICROBIAL SILVER COMPLEX COATED SURFACE
  申请人：MEDACTA INTERNATIONAL SA

  公开号：US20170239394A1

  公开（公告）日：2017-08-24

  The present invention relates to orthopedic implants, in particular to hip and knee prostheses, substantially involving metallic substrates with an antibacterial surface treatment consisting of silver immobilized in an organic linker and ligand via a multistep solution dipping and drying process. This treatment while being biocompatible is designed to inhibit bacterial growth and therefore combat periprosthetic infection which is one of the main causes of revision in hip and knee arthroplasty.
• [EN] ANTIMICROBIAL SILVER COMPLEX COATED SURFACE<br/>[FR] SURFACE REVÊTUE D'UN COMPLEXE D'ARGENT ANTIMICROBIEN
  申请人：MEDACTA INT SA

  公开号：WO2016046725A1

  公开（公告）日：2016-03-31

  The present invention relates to orthopedic implants, in particular to hip and knee prostheses, substantially involving metallic substrates with an antibacterial surface treatment consisting of silver immobilized in an organic linker and ligand via a multistep solution dipping and drying process. This treatment while being biocompatible is designed to inhibit bacterial growth and therefore combat periprosthetic infection which is one of the main causes of revision in hip and knee arthroplasty.