1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane | 749923-77-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane
• 英文别名: 1,5,9,13-tetraaza-6,14-dioxo-8,16-diphenylcyclohexadecane；[16]aneN4；4,12-Diphenyl-1,5,9,13-tetrazacyclohexadecane-2,10-dione
• CAS: 749923-77-1
• 化学式: C₂₄H₃₂N₄O₂
• 分子量: 408.544
• InChiKey: GCWDUTSTPQBWBT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  30
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  82.3
• 氢给体数：
  4
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  硫酸氧钒水合物 、 1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane 在 (C₂H₅)3N 作用下， 以 乙醇 为溶剂， 生成 [VO(1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane)]SO₄
  参考文献：
  名称：

  Synthesis, characterization and liquid-phase hydroxylation of phenol with hydrogen peroxide over host (nanopores of zeolite-Y)/guest (oxovanadium(IV) complexes of tetraaza macrocyclic ligands) nanocatalyst

  摘要：

  Oxovanadium(IV) tetraaza complexes of [14]aneN(4)n: 1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane; [16]aneN(4): 1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane; Bzo(2)[14]aneN(4): dibenzo-1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane and Bzo(2)[16] aneN(4): dibenzo-1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane have been encapsulated in the nanopores of zeolite-Y by a two-step process in the liquid phase: (i) adsorption of [bis(diamine)VO(IV)] (diamine = 1,2-diaminoethane, 1,3-diaminopropane, 1,2-diaminobenzene, 1,3-diaminobenzene); [VO(N-N)(2)](2+)-NaY; in the nanopores of the zeolite-Y and (ii) in situ condensation of the oxovanadium(IV) precursor complex with ethylcinnamate. The new host-guest nanocatalysts were characterized by several techniques: chemical analysis and spectroscopic methods (FT-infrared (FT-IR), ultraviolet-visible (UV-Vis), X-ray diffraction (XRD), nitrogen adsorption and diffuse reflectance spectra (DRS)) technique. The analytical data indicated a composition corresponding to the mononuclear complex of tetraaza ligand. The characterization data showed the absence of extraneous complexes, retention of zeolite crystalline structure and encapsulation in the nanopores. Liquid-phase selective hydroxylation of phenol with H2O2 to a mixture of catechol and hydroquinone in CH3CN have been reported using oxovanadium(IV) tetraaza complexes encapsulated in zeolite-Y as catalysts. All these catalysts are more selective toward catechol formation. (c) 2008 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2008.09.043
• 作为产物：
  描述：

  ethyl (E)-4-phenylbut-3-enoate 、 1,3-丙二胺 在 盐酸 作用下， 以 乙醇 为溶剂， 反应 12.0h， 以77%的产率得到1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane
  参考文献：
  名称：

  Mn（II），Co（II），Ni（II）和Cu（II）与N-供体四齿（N4）大环配体衍生自肉桂酸乙酯部分的光谱研究。

  摘要：

  锰（II），钴（II），镍（II）和铜（II）配合物是用新型四齿配体合成的。1,5,9,13-四氮杂-6,14-二氧杂-8,16-二苯基环十六烷（L）的特征在于元素分析，摩尔电导测量，磁化率测量，质量，1H NMR，IR，电子和EPR光谱研究。DMSO中配合物的摩尔电导测量值对应于Mn（II），Co（II）和Cu（II）的非电解质性质，而Ni（II）配合物的1：2电解质。因此，这些配合物可分别配制成[M（L）X（2）]和[Ni（L）] X（2）（其中M = Mn（II），Co（II）和Cu（II） X = Cl-和NO（3-））。根据红外，电子和EPR光谱研究，已为Mn（II）和Co（II）配合物指定了八面体几何形状，Ni（II）为方形，而Cu（II）络合物为四方。还评估了配体及其复合物在体外对细菌和致病真菌的生长的影响。

  DOI：

  10.1016/j.saa.2003.12.016

文献信息

• Synthesis, characterization, and catalytic oxidation of ethylbenzene over host (zeolite-Y)/guest (copper(II) complexes of tetraaza macrocyclic ligands) nanocomposite materials
  作者：Masoud Salavati-Niasari、Fatemeh Davar

  DOI：10.1080/00958972.2010.510557

  日期：2010.9.20

  precursor complex with ethylcinnamate. The new host–guest nanocomposite materials were characterized by chemical analysis and spectroscopic methods. The “neat” and encapsulated complexes exhibit good catalytic activity in the oxidation of ethylbenzene at 333 K, using tert-butyl hydroperoxide as the oxidant. Acetophenone was the major product though small amounts of o- and p-hydroxyacetophenones were

  14 元和 16 元四氮杂大环配体的 Cu(II) 配合物已通过液相中的两步法封装在沸石-Y 的纳米孔中：（1）吸附 [双（二胺）铜（II）] （二胺 = 1,2-二氨基乙烷、1,3-二氨基丙烷、1,2-二氨基苯和 1,3-二氨基苯）；[Cu(N–N)2]2+–NaY；在沸石-Y 的纳米孔中和 (2) 铜 (II) 前体络合物与肉桂酸乙酯的原位缩合。新的主客体纳米复合材料通过化学分析和光谱方法进行了表征。使用叔丁基过氧化氢作为氧化剂，“纯”和包封的复合物在 333 K 下对乙苯的氧化表现出良好的催化活性。
• Synthesis, characterization of cobalt(II) complex nanoparticles encapsulated within nanoreactors of zeolite-Y and their catalytic activities
  作者：Masoud Salavati-Niasari

  DOI：10.1016/j.molcata.2009.05.018

  日期：2009.9

  Cobalt(II) complex nanoparticles of [14]aneN(4): 1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane [16]aneN(4): 1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane; Bzo(2)[14]aneN(4): dibenzo-1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane and Bzo(2)[16]aneN(4): dibenzo-1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane have been encapsulated in the nanopores of zeolite-Y by a two-step process in the liquid phase: (i) adsorption of [bis(diamine)cobalt(II)] (diamine = 1,2-diaminoethane, 1,3-diaminopropane, 1,2-diaminobenzene, 1,3-diaminobenzene): [Co(N-N)(2)](2+)-NaY; in the nanopores of the zeolite-Y. and (ii) in situ condensation of the cobalt(II) precursor complex with ethylcinnamate. The new complex nanoparticles entrapped in the nanoreactor of zeolite-Y were characterized by several techniques: BET, chemical analysis and spectroscopic methods (FT-IR, UV-vis, XRD, and DRS). These complexes (neat and encapsulated) were used for epoxidation of styrene with O-2 as oxidant in different solvents. Electronic spectra of the reaction mixture indicated that the oxidation proceeds through a free radical mechanism. (C) 2009 Elsevier B.V. All rights reserved.
• Synthesis, characterization and catalytic oxidation of cyclohexene with molecular oxygen with host (nanopores of zeolite-Y)/guest (Ni(II) complexes of 14- and 16-membered tetraaza dioxo diphenyl macrocyclic ligands) nanocomposite materials
  作者：Masoud Salavati-Niasari

  DOI：10.1016/j.poly.2008.06.033

  日期：2008.9

  Ni(II) complexes of [14]aneN(4): 1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane; [16]aneN(4): 1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane; Bzo(2)[14]aneN(4): dibenzo-1,5,8,12-tetraaza-2,9-dioxo-4,11-diphenylcyclotetradecane and Bzo(2)[16]aneN(4): dibenzo-1,5,9,13-tetraaza-2,10-dioxo-4,12-diphenylcyclohexadecane have been encapsulated in the nanopores of zeolite-Y by a two-step process in the liquid phase: (i) adsorption of [bis(diamine)nickel(II)] (diamine = 1,2-diaminoethane, 1,3-diaminopropane, 1,2-diaminobenzene, 1,3-diaminobenzene); [Ni(N-N)(2)](2+)-NaY; in the nanopores of the zeolite-Y, and (ii) in situ condensation of the nickel(II) precursor complex with ethylcinnamate. The new host-guest nanocomposite materials (HGNM) were characterized by several techniques: chemical analysis and spectroscopic methods (FT-IR, UV/Vis, XRD and DRS) and the BET technique. These complexes were used for oxidation of cyclohexene with molecular oxygen. (C) 2008 Elsevier Ltd. All rights reserved.