diethyl 4-(dodecyloxy)pyridine-2,6-dicarboxylate | 679412-90-9

• 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: diethyl 4-(dodecyloxy)pyridine-2,6-dicarboxylate
• 英文别名: Diethyl 4-dodecoxypyridine-2,6-dicarboxylate
• CAS: 679412-90-9
• 化学式: C₂₃H₃₇NO₅
• 分子量: 407.55
• InChiKey: WZBYLFNMKOJWKY-UHFFFAOYSA-N

物化性质

• 熔点：
  47-48 °C(Solv: dichloromethane (75-09-2); methanol (67-56-1))
• 沸点：
  519.1±45.0 °C(Predicted)
• 密度：
  1.026±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  7.5
• 重原子数：
  29
• 可旋转键数：
  18
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  74.7
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  diethyl 4-(dodecyloxy)pyridine-2,6-dicarboxylate 在 sodium tetrahydroborate 、 calcium chloride 作用下， 以 乙醇 为溶剂， 反应 3.0h， 以92%的产率得到[4-Dodecoxy-6-(hydroxymethyl)pyridin-2-yl]methanol
  参考文献：
  名称：

  Efficient and selective transport of ω-amino acids across a bulk chloroform membrane by a macrocyclic dicopper(II) complex

  摘要：

  The Cu(II) complex of a ditopic macrocyclic ligand efficiently transports omega-amino acids of different length across a bulk chloroform membrane with promising selectivity. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2003.12.125
• 作为产物：
  描述：

  4-氧代-1,4-二氢-2,6-吡啶二甲酸 在 硫酸 、 potassium carbonate 、 potassium iodide 作用下， 以 乙腈 为溶剂， 反应 16.0h， 生成 diethyl 4-(dodecyloxy)pyridine-2,6-dicarboxylate
  参考文献：
  名称：

  将分子催化剂固定在碳纳米管上，以实现高效的电催化水氧化。

  摘要：

  已经使用固定在杂化碳纳米管和纳米材料电极上的分子水氧化催化剂进行了电化学驱动的水氧化。在批量电解1 h后，在480 mV的超电势下成功获得了7.6 s（-1）的高周转频率（TOF）和2.2 mA cm（-2）的高催化电流密度。

  DOI：

  10.1039/c4cc06959e

文献信息

• A pentadentate member of the picolinate family for Mn(<scp>ii</scp>) complexation and an amphiphilic derivative
  作者：Rosa Pujales-Paradela、Fabio Carniato、Rocío Uzal-Varela、Isabel Brandariz、Emilia Iglesias、Carlos Platas-Iglesias、Mauro Botta、David Esteban-Gómez

  DOI：10.1039/c8dt03856b

  日期：——

  also characterised the related [Mn(nta)]− complex (nta = nitrilotriacetate). Both the [Mn(paada)]− and [Mn(nta)]− complexes turned out to contain two inner-sphere water molecules in aqueous solution. The exchange rate of these coordinated water molecules was slower in [Mn(paada)]− (k298ex = 90 × 107 s−1) than in [Mn(nta)]− (k298ex = 280 × 107 s−1). The complexes were also characterised using both DFT

  我们报告了一个五齿配体，其中包含一个在氮原子上被吡啶甲酸基团官能化的2,2'-氮杂二烯基二烯二酸部分（H 3 paada），以及在吡啶基环的第4个位置被十二烷氧基官能化的脂族衍生物3 C 12 Opaada）。使用电位滴定法和分光光度滴定法（25°C，0.15 M NaCl）的组合测定了paada 3-配体的质子化常数和Mn（II）络合物的稳定性。通过记录1 H核磁弛豫色散（NMRD）曲线和17O化学位移和弛豫率。这些研究提供了关于微观参数的详细信息，这些微观参数控制了它们在体外作为松弛剂的效率。为了完整性和便于比较，我们还对相关的[Mn（nta）] -配合物（nta =次氮基三乙酸酯）进行了表征。结果表明，[Mn（paada）] -和[Mn（nta）] -配合物在水溶液中均包含两个内层水分子。这些配位水分子的交换速率在[Mn（paada）] -（k 298 ex = 90×10 7 s -1）中比在[Mn（nta）]
• Mechanochemistry with Metallosupramolecular Polymers
  作者：Diederik W. R. Balkenende、Souleymane Coulibaly、Sandor Balog、Yoan C. Simon、Gina L. Fiore、Christoph Weder

  DOI：10.1021/ja5051633

  日期：2014.7.23

  The transduction of mechanical force into useful chemical reactions is an emerging design approach to impart soft materials with new functions. Here, we report that mechanochemical transductions can be achieved in metallosupramolecular polymers. We show that both reversible and irreversible reactions are possible and useful to create mechanically studied was a cross-linked network assembled from a europium salt and a responsive materials that display new functions. The metallopolymer telechelic poly(ethylene-co-butylene) with 2,6-bis(1'-methyl-benzimidazolyl)pyridine (Mebip) ligands at the termini. The Eu3+ complexes serve both as mechanically responsive binding motifs and as built-in optical probes that can monitor the extent of (dis)assembly due to their characteristic photoluminescent properties. Indeed, dose-dependent and reversible metal ligand dissociation occurs upon exposure to ultrasound in solution. The absence of ultrasound-induced dissociation of a low-molecular weight model complex and in-depth studies of temperature effects confirm that the dissociation is indeed the result of mechanical activation. The influence of the strength of the metal-ligand interactions on the mechanically induced dissociation was also explored. Metallopolymers in which the Mebip ligands were substituted with more strongly coordinating dipicolinate (dpa) ligands do not dissociate upon exposure to ultrasound. Finally, we show that mechanochemical transduction in metallosupramolecular polymers is also possible in the solid state. We demonstrate mending of damaged objects through ultrasound as well as mechanochromic behavior based on metal-exchange reactions in metallopolymers imbibed with an auxiliary metal salt.