1,1'-binaphthalenyl-2,2'-diamine-N,N,N',N'-tetraacetic acid | 1422286-12-1

• 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: 1,1'-binaphthalenyl-2,2'-diamine-N,N,N',N'-tetraacetic acid
• 英文别名: 2-[[1-[2-[Bis(carboxymethyl)amino]naphthalen-1-yl]naphthalen-2-yl]-(carboxymethyl)amino]acetic acid；2-[[1-[2-[bis(carboxymethyl)amino]naphthalen-1-yl]naphthalen-2-yl]-(carboxymethyl)amino]acetic acid
• CAS: 1422286-12-1
• 化学式: C₂₈H₂₄N₂O₈
• 分子量: 516.507
• InChiKey: GGQRVFSRRXGNTJ-UHFFFAOYSA-N

物化性质

• 沸点：
  872.8±65.0 °C(Predicted)
• 密度：
  1.503±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  38
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  156
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  1,1'-binaphthalenyl-2,2'-diamine-N,N,N',N'-tetraacetic acid 、 水 、 manganese (II) acetate tetrahydrate 在 三乙胺 作用下， 以 乙腈 为溶剂， 反应 72.0h， 以33%的产率得到
  参考文献：
  名称：

  基于1,1'-联萘基-2,2'-二胺-N，N，N'，N'-四乙酸的一系列过渡金属配合物的结构多样性和磁性

  摘要：

  摘要五种配合物[Mn2（L）（H2O）5]·3H2O（1），[Fe（L）]（Et3N + H）（2），{[Co2（L）（H2O）4]·2.25H2O}通过自组装合成了n（3），{[Ni2（L）（H2O）4]·2H2O} n（4）和{[CuNa2（L）（H2O）5]·H2O} n（5）。含N的多元羧酸配体H4L和相应的金属盐的平均值，H4L ＝ 1,1'-联萘基-2,2'-二胺-N，N，N'，N'-四乙酸。有趣的是，根据金属离子的身份，复合物1-5在离散的0D到1D配位聚合物和2D骨架之间显示出结构变化。1的结构是双核，2的结构是单核。配合物3和4表现出相似的结构，其中金属离子通过将L4-的顺反和反反桥接羧酸根基团交替连接成锯齿形链而结合在一起。配合物5是由三核单元[CuNa2（L）（H2O）5]构成的新型3s-3d杂金属2D聚合物。

  DOI：

  10.1016/j.ica.2013.08.017
• 作为产物：
  描述：

  tetraethyl 2,2',2'',2'''-([1,1'-binaphthalene]-2,2'-diylbis(azanetriyl))tetraacetate 在 sodium hydroxide 作用下， 以 乙醇 、 水 为溶剂， 反应 24.0h， 以76%的产率得到1,1'-binaphthalenyl-2,2'-diamine-N,N,N',N'-tetraacetic acid
  参考文献：
  名称：

  Syntheses, structures, and fluorescence properties of cadmium(II) and zinc(II) complexes based on 1,1′-binaphthalenyl-2,2′-diamine-N,N,N′,N′-tetraacetic acid

  摘要：

  Solvothermal reaction of Cd(II)/Zn(II) salts with 1,1'-binaphthaleny1-2,2'-diamine-N,N,N',N'-tetraacetic acid (H4L) ligand results in the formation of five interesting complexes [Cd-2(L)(phen)(2)(H2O)]center dot 2H(2)O (1), [Cd-4(L)(2)(phen)(2)(H2O)7]center dot CH3OH center dot 10H(2)O (2), ([Cd-5(L)(2)(H2O)(3)(OH)(2)]center dot H2O)n (3), [Zn-2(L)(phen)(2)(H2O)]center dot 2H(2)O (4) and {[Zn-2(L)(H2O)(4)]center dot 2.25H(2)O}(n) (5), where phen = 1,10-phenanthroline. The structure of 1 is dinuclear, and that of 2 is tetranuclear. The structural difference of 1 and 2 indicates a temperature-dependence of the formation of two complexes. 3 Is a 20 polymer with a (6,3) network constructed by a novel asymmetrical pentanuclear Cd clusters with bridging hydroxyl and carboxylate groups as secondary building units, which have never been employed before in the construction of 2D networks. 4 Is a dinuclear compound with a structure similar to that of 1. Complex 5 exhibits a zigzag chain structure bridged by L4- ligand. A variety of coordination modes of the H4L, ligand were found, some of them are unprecedented for these type of compounds. The fluorescence properties of the compounds were studied, and strong fluorescent emissions were observed. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2012.10.042

文献信息

• Syntheses, structures, and fluorescence properties of cadmium(II) and zinc(II) complexes based on 1,1′-binaphthalenyl-2,2′-diamine-N,N,N′,N′-tetraacetic acid
  作者：Wan-Yun Huang、Zi-Lu Chen、Hua-Hong Zou、Dong-Cheng Liu、Fu-Pei Liang

  DOI：10.1016/j.poly.2012.10.042

  日期：2013.2

  Solvothermal reaction of Cd(II)/Zn(II) salts with 1,1'-binaphthaleny1-2,2'-diamine-N,N,N',N'-tetraacetic acid (H4L) ligand results in the formation of five interesting complexes [Cd-2(L)(phen)(2)(H2O)]center dot 2H(2)O (1), [Cd-4(L)(2)(phen)(2)(H2O)7]center dot CH3OH center dot 10H(2)O (2), ([Cd-5(L)(2)(H2O)(3)(OH)(2)]center dot H2O)n (3), [Zn-2(L)(phen)(2)(H2O)]center dot 2H(2)O (4) and [Zn-2(L)(H2O)(4)]center dot 2.25H(2)O}(n) (5), where phen = 1,10-phenanthroline. The structure of 1 is dinuclear, and that of 2 is tetranuclear. The structural difference of 1 and 2 indicates a temperature-dependence of the formation of two complexes. 3 Is a 20 polymer with a (6,3) network constructed by a novel asymmetrical pentanuclear Cd clusters with bridging hydroxyl and carboxylate groups as secondary building units, which have never been employed before in the construction of 2D networks. 4 Is a dinuclear compound with a structure similar to that of 1. Complex 5 exhibits a zigzag chain structure bridged by L4- ligand. A variety of coordination modes of the H4L, ligand were found, some of them are unprecedented for these type of compounds. The fluorescence properties of the compounds were studied, and strong fluorescent emissions were observed. (C) 2012 Elsevier Ltd. All rights reserved.
• Structural diversity and magnetic properties of a series of transition metal complexes based on 1,1′-binaphthalenyl-2,2′-diamine-N,N,N′,N′-tetraacetic acid
  作者：Wan-Yun Huang、Zi-Lu Chen、Hua-Hong Zou、Kai Wang、Dong-Cheng Liu、Qiong Hu、Yan-Ling Shen、Fu-Pei Liang

  DOI：10.1016/j.ica.2013.08.017

  日期：2013.11

  Abstract Five complexes, [Mn2(L)(H2O)5]·3H2O (1), [Fe(L)](Et3N+H) (2), [Co2(L)(H2O)4]·2.25H2O}n (3), [Ni2(L)(H2O)4]·2H2O}n (4) and [CuNa2(L)(H2O)5]·H2O}n (5), have been synthesized by self-assembly of a N-containing polycarboxylic acid ligand H4L and corresponding metal salts, H4L = 1,1′-binaphthalenyl-2,2′-diamine-N,N,N′,N′-tetraacetic acid. Interestingly, complexes 1–5 display a structural variation

  摘要五种配合物[Mn2（L）（H2O）5]·3H2O（1），[Fe（L）]（Et3N + H）（2），[Co2（L）（H2O）4]·2.25H2O}通过自组装合成了n（3），[Ni2（L）（H2O）4]·2H2O} n（4）和[CuNa2（L）（H2O）5]·H2O} n（5）。含N的多元羧酸配体H4L和相应的金属盐的平均值，H4L ＝ 1,1'-联萘基-2,2'-二胺-N，N，N'，N'-四乙酸。有趣的是，根据金属离子的身份，复合物1-5在离散的0D到1D配位聚合物和2D骨架之间显示出结构变化。1的结构是双核，2的结构是单核。配合物3和4表现出相似的结构，其中金属离子通过将L4-的顺反和反反桥接羧酸根基团交替连接成锯齿形链而结合在一起。配合物5是由三核单元[CuNa2（L）（H2O）5]构成的新型3s-3d杂金属2D聚合物。