1,3-bis-[3'-aza-4'-(3-methyl-2'-hydroxyphenyl)-prop-4-en-1'-yl]ethane-1,2-diamine | 748133-89-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 1,3-bis-[3'-aza-4'-(3-methyl-2'-hydroxyphenyl)-prop-4-en-1'-yl]ethane-1,2-diamine
• 英文别名: 1,8-bis(2-hydroxyacetophenonimine)-3,6-diazaoctane；H2aea；2-[N-[2-[2-[2-[1-(2-hydroxyphenyl)ethylideneamino]ethylamino]ethylamino]ethyl]-C-methylcarbonimidoyl]phenol
• CAS: 748133-89-3
• 化学式: C₂₂H₃₀N₄O₂
• 分子量: 382.506
• InChiKey: GGJMASREKUTYEH-UHFFFAOYSA-N

物化性质

• 沸点：
  540.6±50.0 °C(Predicted)
• 密度：
  1.12±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  28
• 可旋转键数：
  11
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  89.2
• 氢给体数：
  4
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-甲基苯甲醛 、 1,3-bis-[3'-aza-4'-(3-methyl-2'-hydroxyphenyl)-prop-4-en-1'-yl]ethane-1,2-diamine 以 甲醇 为溶剂， 以53 %的产率得到2-(2′-hydroxyphenyl)-1,3-bis[4-methyl-4-(2-hydroxyphenyl)-3-azabut-3-enyl]-1,3-imidazolidine
  参考文献：
  名称：

  咪唑烷基酚盐支持的二铜（II/II）配合物的简便合成：大气中 CO2 的活化和固定为 MeOCO2−，显示外源桥调节磁交换耦合

  摘要：

  两种咪唑烷接枝席夫碱 H3L2 和 H3L3 用于固定四种新配合物中的 Cu2 核 [Cu2(μ-L2)(μ-O2CMe)]·H2O (1·H2O)、[Cu2(μ-L2)(μ -O2COMe)]·H2O (2·H2O)、[Cu2(μ-L2)(μ-NO3)]·H2O (3·H2O) 和 [Cu2L3(μ-OAc)]·5H2O (4·5H2O)。 H3L2 与 Cu2(OAc)4·2H2O 的室温溶液反应以良好的产率提供 1·H2O。 1·H2O 与空气中的 Et4NOH 的后续反应通过 2·H2O 中的 MeOCO2−（单甲基碳酸）连接基取代 μ-O2CMe（乙酸根）桥。单晶 X 射线结构确定了各个配合物并证实了大气 CO2 的固定。变温（2 至 300 K）磁化率测量识别了配合物 2 和 3 中相邻铜（II）中心之间的反铁磁交换相互作用。发现辅助 NO3− 桥的自旋-自旋相互作用量较高（−284

  DOI：

  10.1016/j.ica.2024.122298
• 作为产物：
  描述：

  2'-羟基苯乙酮 、 三乙烯四胺 以 甲醇 为溶剂， 反应 4.0h， 以88%的产率得到1,3-bis-[3'-aza-4'-(3-methyl-2'-hydroxyphenyl)-prop-4-en-1'-yl]ethane-1,2-diamine
  参考文献：
  名称：

  Synthesis, crystal structure and spectroscopic studies of a cobalt(III) Schiff base complex and its use as a heterogeneous catalyst for the oxidation reaction under mild condition

  摘要：

  A new Schiff base oriented Co(III) complex, (CoL)Cl center dot 4H(2)O (L = Schiff base), has been synthesized by careful design of the Schiff base ligand thorough oxidation of Co(II) to Co(III) during the reaction process. The complex has been characterized by single-crystal X-ray structure analysis and various spectral analyses. Structure analysis reveals that this monomeric complex crystallizes in triclinic P-1 space group. Supramolecular hydrogen bonding interactions among the guest water Molecules and counter anion chloride leads to the formation of 1D water-chloride chain. A polymer anchored heterogeneous cobalt complex has been synthesized, characterized by various physicochemical techniques and successfully used for the oxidation of alkenes and sulfides using H2O2 as oxygen source. The influence of the various reaction parameters has been studied. The heterogeneous cobalt complex can be reused seven times without any significant loss in its catalytic activity. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2013.09.022

文献信息

• The synthesis of iron(III) and cobalt (III) complexes of facultative hexadentate ligands. The X-ray crystal structure of [Fe{(NC4H3-2-CHNHH2CH2NHCH2)2}]PF6
  作者：Anne S. Rothin、Hilary J. Banbery、Frank J. Berry、Thomas A. Hamor、Christopher J. Jones、Jon A. McCleverty

  DOI：10.1016/s0277-5387(00)80747-0

  日期：1989.1

  2-hydroxybenzophenone or pyrrole-2-aldehyde, and from 3-methoxysalicylaldehyde with tris(2-aminoethyl)amine. Their ability to encapsulate cobalt(III) and iron(III) in complexes of 1 : 1 ligand—metal stoichiometry is reduced by the incorporation of sulphur donor atoms, or by the replacement of the terminal six-membered chelate rings of the salicylaldehyde derivatives by a five-membered ring in the pyrrole—aldehyde

  摘要由1,8-二氨基-3,6-二氮辛烷或1,8-二氨基-3,6-二硫辛烷与1-羟基-3-甲氧基-二苯甲酮，2-羟基苯乙酮缩合制备了一系列六齿配体。 ，2-羟基二苯甲酮或吡咯-2-醛，以及3-甲氧基水杨醛与三（2-氨基乙基）胺的结合。通过掺入硫供体原子或通过用水杨醛衍生物取代末端的六元螯合环，降低了它们将钴（III）和铁（III）以1：1配位体-金属化学计量的络合物包封的能力。吡咯-醛衍生物中的五元环。报道了铁络合物的莫斯鲍尔光谱数据，并且[Fe （NC4H3-2-CH = NCH2CH2NHCH2）2}] PF6的分子结构已通过单晶X射线衍射技术确定。
• Mono and bimetallic CoIII Schiff base complexes: Coordination induced ligand imidazolidine ring cleavage and stabilization
  作者：Supriti Paul、Wing-Tak Wong、Debashis Ray

  DOI：10.1016/j.ica.2011.03.058

  日期：2011.6

  2-(2'-Hydroxyphenyl) imidazoline ring grafted dinucleating diimine-diamine-tris-phenol ligand (H(3)aeas) has been obtained from a two-step reaction of 2-hydroxy acetophenone, N,N'-bis-(2-aminoethyl)ethylenediamine and 2-hydroxy benzaldehyde. Reaction of the ligand with Co(ClO4)(2)center dot 6H(2)O and NEt3 in MeOH-DCM solvent mixture yielded the monometallic complex [Co(aea)]ClO4 center dot H2O (1) of imidazolidine ring hydrolyzed hexadentate proligand H(2)aea. Any solvent derived MeO bridged Co-2 complex could not be obtained due to facile cobalt coordination assisted hydrolytic cleavage of substituted imidazolidine ring. When the reaction is carried out with Co(NO3)(2)center dot 4H(2)O and CoCl2 center dot 6H(2)O in presence of NH4NCS and NaN3 in MeOH-DCM and MeOH under aerobic conditions, preassembly of bimetallic [Co-2(mu-OMe)](5+) and [Co-2(mu-N-3)](5+) cores takes place on the solvent derived methoxido and azido clips through non-hydrolytic pathways in [(SCN)(2)Co-2(mu-OMe)(mu-aeas)]center dot DMF (2), and cocrystals of [(N-3)(2)Co-2(mu-OMe)(mu-aeas)] (3a) and [(N-3)(2)Co-2(mu-N-3)(mu-aeas)] (3b), respectively. Crown Copyright (C) 2011 Published by Elsevier B. V. All rights reserved.
• A Novel μ₄-Oxo Bridged Copper Tetrahedron Derived by Self-Assembly:  First Example of Double Helical Bis(Tridentate) Coordination of a Hexadentate Amine Phenol Ligand
  作者：Manindranath Bera、Wing Tak Wong、Guillem Aromi、Joan Ribas、Debashis Ray

  DOI：10.1021/ic049817+

  日期：2004.8.1

  In methanol, the reaction of Cu(ClO4)(2).6H(2)O and the hexadentate amine phenol ligand (H(2)bahped) in the presence of triethylamine affords a tetranuclear copper(II) complex having, the formula [Cu-4(mu(4)-O)(bahped)(2)](ClO4)(2). The X-ray structure of this complex shows a tetrahedral central Cu-4(II)(mu(4)-O)} unit coordinated to two hexadentate bridging (via the central ethylenediamine part) ligands. The compound is the first example of a mu(4)-OXO tetranuclear copper(II) complex without any bridging ligand along the six tetrahedral edges. Variable-temperature magnetic data clearly show an S-t = 0 spin ground state for antiferromagnetic interactions between four B-2(2) copper(II) ions in a dimer of dimers.