三[2-(4-氨基苯氧基)乙基]胺 | 106843-96-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 中文名称: 三[2-(4-氨基苯氧基)乙基]胺
• 英文名称: tris[2-(4-aminophenoxy)ethyl]amine
• 英文别名: Tris-<β-(4-amino-phenoxy)-aethyl>-amin；Tris-[β-(4-amino-phenoxy)-aethyl]-amin；4-[2-[bis[2-(4-aminophenoxy)ethyl]amino]ethoxy]aniline
• CAS: 106843-96-3
• 化学式: C₂₄H₃₀N₄O₃
• 分子量: 422.527
• InChiKey: IUUSVDRWOMTIKR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  31
• 可旋转键数：
  12
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  109
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  三[2-(4-氨基苯氧基)乙基]胺 在 水 、 氢碘酸 作用下， 反应 1.0h， 以80%的产率得到
  参考文献：
  名称：

  Hydrated anion glued capsular and non-capsular assembly of a tripodal host: Solid state recognition of bromide–water [Br₅–(H₂O)₆]⁵⁻ and iodide–water [I₂–(H₂O)₄]²⁻ clusters in cationic tripodal receptor

  摘要：

  在这份报告中，我们描述了多胺三脚架受体的胶囊和非胶囊组装，通过阴离子或阴离子-水团簇驱动形成超分子网络，并且实现了对独特的溴化物-水[Br₅–(H₂O)₆]⁵⁻和碘化物-水[I₂–(H₂O)₄]²⁻团簇的固态识别。

  DOI：

  10.1039/c4ce00149d
• 作为产物：
  描述：

  三(2-氯乙基)胺盐酸盐 在 镍 氢气 作用下， 以 乙醇 为溶剂， 生成 三[2-(4-氨基苯氧基)乙基]胺
  参考文献：
  名称：

  Wolf,L.; Uhlig,E., Journal fur praktische Chemie (Leipzig 1954), 1961, vol. 14, p. 99 - 107

  摘要：

  DOI：

文献信息

• Anion complexation with cyanobenzoyl substituted first and second generation tripodal amide receptors: crystal structure and solution studies
  作者：Md. Najbul Hoque、Abhijit Gogoi、Gopal Das

  DOI：10.1039/c5dt00369e

  日期：——

  for the anion which results in side cleft anion binding. However, in L2 we conveniently shift the anion binding sites to a distant position which increases cavity size as well as rules out any intramolecular H-bonding between amide N–H and CO. The crystal structure shows a different orientation of the arms in L2; it adopts a quasi-planar arrangement with C2v symmetry. In the crystal structure two arms

  在这里已经广泛研究了两种新的三脚架酰胺受体的阴离子络合特性。由氰基苯甲酰氯与两个三胺结构单元如（i）三（2-氨基乙基）胺和（ii）三（2-（4-氨基苯氧基）乙基）胺反应合成了两个三脚受体。分别产生了第一代（L 1）和第二代（L 2）三脚酰胺。还通过晶体学和溶液状态实验描述了它们与阴离子的配位行为的详细比较。晶体结构显示了三脚架臂在两个受体中的各种类型的空间取向，并与阴离子显着地相互作用。酰胺NH和C之间的分子内H键O阻止晶体中受体腔的开放，这导致具有C 3v对称性的L 1的锁定构象，并使酰胺氢不可用于阴离子，从而导致侧裂阴离子结合。但是，在L 2中，我们可以方便地将阴离子结合位点移至较远的位置，这会增加空腔的大小，并排除了酰胺N–H和C O之间的任何分子内H键。L 2 ; 它采用C 2v的准平面排列对称。在晶体结构中，两个臂指向相同的方向，并且在扩展接触时，第三个臂通过–CN基团与顶端N原
• TRIPOD-LIKE COMPOUNDS: SYNTHESES OF TRIS(p- OR o-AMINO PHENOXYMETHYL)-PROPANE, TRIS(p- OR o-AMINO PHENOXYETHYL)AMINE, AND THEIR SCHIFF BASE OR SALICYL DERIVATIVES
  作者：Huijie Lu、Yaoting Fan、Qinghuan Zhao、Yangjie Wu

  DOI：10.1081/scc-100104066

  日期：2001.1

  prepared by the reaction of trimethylol propane or triethanol amine with p- or o-chloronitrobenzene, were reduced to give the corresponding amines. The amines condensed with 2-pyridinecarboxaldehyde, 2-quinolinecarboxaldehyde, or salicylaldehyde to give the tripod Schiff bases. The tripodal salicylamides were obtained by condensation of salicylic acid with the amines in the presence of phosphorus trichloride

  三(硝基苯氧基甲基)丙烷和三(硝基苯氧基乙基)胺，由三羟甲基丙烷或三乙醇胺与对-或邻-氯硝基苯反应制备，还原得到相应的胺。胺与 2-吡啶甲醛、2-喹啉甲醛或水杨醛缩合得到三脚架席夫碱。在三氯化磷的存在下，通过水杨酸与胺的缩合获得三足水杨酰胺。
• Encapsulation of a discrete cyclic halide water tetramer [X2(H2O)2]2−, X = Cl−/Br− within a dimeric capsular assembly of a tripodal amide receptor
  作者：Arghya Basu、Gopal Das

  DOI：10.1039/c3cc40955d

  日期：——

  A conformationally flexible C3v symmetric N-bridged tripodal amide receptor encapsulates a tetrameric halide water cluster [X2(H2O)2]2− (X = Cl−/Br−) within its dimeric capsular assembly and forms a non-capsular 1D polymeric assembly with higher homologous iodide anions upon protonation.

  一种构象灵活的 C3v 对称 N-桥联三足型酰胺受体在其二聚体囊泡组装体内包封了四聚体卤化物水簇[X2(H2O)2]2-(X = Cl-/Br-)，并在质子化后与高同系碘离子形成非囊泡型一维聚合物组装体。
• A <i>C</i>_3<i>v</i>-Symmetric Tripodal Urea Receptor for Anions and Ion Pairs: Formation of Dimeric Capsular Assemblies of the Receptor during Anion and Ion Pair Coordination
  作者：Arghya Basu、Gopal Das

  DOI：10.1021/jo500102e

  日期：2014.3.21

  A new C-3v-symmetric urea-based heteroditopic tripodal receptor capable of recognizing both anions and ion pairs was designed, synthesized, and characterized. The protonated receptor forms a sulfate complex which encapsulates a single DMF in the tripodal cavity of the receptor. However, the SO42- anion is located outside the tripodal cavity and is stabilized by N-H center dot center dot center dot O hydrogen bonds from the urea functions of four receptor cations. With TBAHSO(4) the receptor forms a contact ion pair complex, where both the TBA(+) and SO42- groups are pseudoencapsulated in the tripodal cavity of the protonated receptor. Significantly, the receptor forms a charge-separated polymeric ion pair complex with K+ and HPO42- via formation of a dimeric capsular assembly of the receptor, in which three K+ encapsulated dimeric capsular assemblies interdigitate to form a precise cavity that further encapsulates HPO42-. The receptor also forms an anion complex with CO32- via formation of dimeric capsular self-assembly of the receptor. Solution-state binding studies of the receptor with oxyanions have also been carried out by H-1 NMR titration experiments, which show the oxyanion binding trend HCO3- > H2PO4- > HSO4-, whereas no binding with NO3- and ClO4- anions is observed.
• Encapsulation of fluoride and hydrogen sulfate dimer by polyammonium-functionalised first- and second-generation tripodal: cavity-induced anion encapsulation
  作者：Md. Najbul Hoque、Utsab Manna、Gopal Das

  DOI：10.1080/10610278.2015.1102259

  日期：2016.4.2

  Design, synthesis and complexation with inorganic anions of first (L-1) and second (L-2) generation tripodal polyamine receptors are reported here. The C-3v symmetric second-generation tripodal receptor (L-2) possesses large enough cavity to encapsulate larger hydrogen sulfate dimer in a unimolecular capsular fashion [(HSO4)(2)subset of 2]. The dimer is stabilised by (NH)O+ type H-bonding and electrostatic interactions between HSO4- and ammonium group. Water of crystallisation form hybrid anion-water cluster [(HSO4)-(H2O) HSO4- ions located outside the cavity. The [(HSO4)-(H2O) HSO4- cluster and ClCl halogen bond play templating role in the supramolecular aggregation of unimolecular capsule [(HSO4)(2) subset of(2)]. On the other hand, first-generation receptor (L-1) encapsulates only fluoride ion due to its smaller cavity size and thus form unimolecular fluoride complex [F subset of 1]. Overall study shows cavity size-induced anion encapsulation. All complexes are well characterised by FT-IR, NMR, TGA, DSC and XRD experiments.