2,2'-[pentane-1,5-diylbis(azanediyl)]ditropone | 86007-91-2

• 分子结构分类: 有机化合物 - 碳氢化合物衍生物 - 环庚三烯酮
• 英文名称: 2,2'-[pentane-1,5-diylbis(azanediyl)]ditropone
• 英文别名: 2-[5-[(7-Oxocyclohepta-1,3,5-trien-1-yl)amino]pentylamino]cyclohepta-2,4,6-trien-1-one
• CAS: 86007-91-2
• 化学式: C₁₉H₂₂N₂O₂
• 分子量: 310.396
• InChiKey: ZIDZZSWBODJBTO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  23
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  58.2
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2,2'-[pentane-1,5-diylbis(azanediyl)]ditropone 在 六甲基磷酰三胺 作用下， 以 乙醇 、 氯仿 为溶剂， 反应 38.5h， 生成 6,7,8,9,10,11,18,19,20,21,22,23-dodecahydrodicyclohepta<1,4,10,13>tetraazacyclooctadecine
  参考文献：
  名称：

  Tropocoronands, a new class of metal-complexing macrocycles derived from aminotroponeiminates

  摘要：

  DOI：

  10.1021/ja00345a070
• 作为产物：
  描述：

  环庚三烯酚酮 、 alkaline earth salt of/the/ methylsulfuric acid 在 三乙胺 作用下， 以 乙醇 为溶剂， 生成 2,2'-[pentane-1,5-diylbis(azanediyl)]ditropone
  参考文献：
  名称：

  SYNTHESIS AND X-RAY CRYSTALLOGRAPHY OF CHIRAL TROPOCORONANDS

  摘要：

  The synthesis of several chiral tropocoronands (6 and 7) has been accomplished. These compounds have been shown to complex with various metals. Tropocoronands that have been synthesized include H-2(TC-3,cyhex) through H2(TC-G,cyhex) (6) and H-2(TC-3,diphen) through H-2(TC-6,diphen) (7). The route is short and the tropocoronands are easily purified by chromatography or recrystallization. Two other groups have been incorporated into tropocoronands, H-2(TC-3,binap) (9) and H-2(TC-6,pent) (10).

  DOI：

  10.1081/scc-100000574

文献信息

• Coordination complexes for detecting analytes, and methods of making and using the same
  申请人：——

  公开号：US20030068275A1

  公开（公告）日：2003-04-10

  The present invention is directed, in part, to coordination complexes for detecting analytes, and methods of making and using the same.

  本发明部分涉及用于检测分析物的配位络合物，以及制备和使用该配位络合物的方法。
• A clothes-peg-shaped binuclear<i>trans</i>-bis(2-aminotroponato)palladium(II) complex bearing pentamethylene spacers
  作者：Naruyoshi Komiya、Takeharu Kageyama、Masaya Naito、Takeshi Naota

  DOI：10.1107/s0108270113004484

  日期：2013.5.15

  rac‐Bisμ‐trans‐2,2′‐[pentane‐1,5‐diylbis(azanediyl)]ditroponato}dipalladium(II), [Pd2(C19H20N2O2)2], has been synthesized and fully characterized using single‐crystal X‐ray diffraction, 1H NMR, FT–IR and mass spectroscopy. The trans coordination, vaulted structure and anti conformation have been unequivocally established from the X‐ray diffraction studies. This is the first example of a bis(aminotroponato)palladium

  rac -Bis μ-反式-2,2'-[戊烷-1,5-二基双（氮杂二基）]对苯二甲酸酯}二钯（II），[Pd 2（C 19 H 20 N 2 O 2）2 ]合成并使用单晶X射线衍射，1 H NMR，FT-IR和质谱进行了全面表征。该反式协调，拱形结构和防X射线衍射研究明确地确定了构象。这是双（氨基troponato）钯配合物的第一个例子。在结晶状态下，该分子具有双重对称性，每个分子单元经历分子间错位的tropone环π堆积，以提供以层状方式与人字形堆积基序对齐的异手性互穿二聚体。
• SYNTHESIS AND X-RAY CRYSTALLOGRAPHY OF CHIRAL TROPOCORONANDS
  作者：Philip J. Chenier、Jason A. Halfen、Tami L. Raguse、Autumn E. Rich、Kathryn E. Splan、Kazuki Yoshioka、Thomas R. Hoye

  DOI：10.1081/scc-100000574

  日期：2001.1

  The synthesis of several chiral tropocoronands (6 and 7) has been accomplished. These compounds have been shown to complex with various metals. Tropocoronands that have been synthesized include H-2(TC-3,cyhex) through H2(TC-G,cyhex) (6) and H-2(TC-3,diphen) through H-2(TC-6,diphen) (7). The route is short and the tropocoronands are easily purified by chromatography or recrystallization. Two other groups have been incorporated into tropocoronands, H-2(TC-3,binap) (9) and H-2(TC-6,pent) (10).
• Tropocoronands, a new class of metal-complexing macrocycles derived from aminotroponeiminates
  作者：Seichi Imajo、Koji Nakanishi、Michael Roberts、Stephen J. Lippard、Tetsuo Nozoe

  DOI：10.1021/ja00345a070

  日期：1983.4