trimethyl 2,2',2"-(adamantane-1,3,5-triyl)triacetate | 1587704-35-5

• 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: trimethyl 2,2',2"-(adamantane-1,3,5-triyl)triacetate
• 英文别名: Methyl 2-[3,5-bis(2-methoxy-2-oxoethyl)-1-adamantyl]acetate；methyl 2-[3,5-bis(2-methoxy-2-oxoethyl)-1-adamantyl]acetate
• CAS: 1587704-35-5
• 化学式: C₁₉H₂₈O₆
• 分子量: 352.428
• InChiKey: BGFNRKGLMWGCFS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  25
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  78.9
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  trimethyl 2,2',2"-(adamantane-1,3,5-triyl)triacetate 在 肼 作用下， 以 乙醇 为溶剂， 反应 6.0h， 以100%的产率得到2,2',2"-(adamantane-1,3,5-triyl)triacetic acid trihydrazide
  参考文献：
  名称：

  Diamondoid Hydrazones and Hydrazides: Sterically Demanding Ligands for Sn/S Cluster Design

  摘要：

  A series of new adamantane and diamantane hydrazides was synthesized and coupled with organo-functionalized Sn/S clusters of the general type [(RSn4S6)-Sn-I] (R-I = CMe2CH2COMe) to form diamondoid-decorated Sn/S dusters. The new ligand precursors as well as the resulting hybrid compounds were analyzed by NMR spectroscopy, mass spectrometry, and single-crystal X-ray diffraction, and first insights were gained in the installation of sterically highly demanding and at the same time rigid mono-, di-, and trifunctionalized diamondoid ligands on tetrelchalcogenide cages.

  DOI：

  10.1021/om500014z
• 作为产物：
  描述：

  甲醇 、 Tricylc[3.3.1.1(3,3,5-triacetic acid 在 硫酸 作用下， 反应 20.0h， 以1.42 g的产率得到trimethyl 2,2',2"-(adamantane-1,3,5-triyl)triacetate
  参考文献：
  名称：

  Diamondoid Hydrazones and Hydrazides: Sterically Demanding Ligands for Sn/S Cluster Design

  摘要：

  A series of new adamantane and diamantane hydrazides was synthesized and coupled with organo-functionalized Sn/S clusters of the general type [(RSn4S6)-Sn-I] (R-I = CMe2CH2COMe) to form diamondoid-decorated Sn/S dusters. The new ligand precursors as well as the resulting hybrid compounds were analyzed by NMR spectroscopy, mass spectrometry, and single-crystal X-ray diffraction, and first insights were gained in the installation of sterically highly demanding and at the same time rigid mono-, di-, and trifunctionalized diamondoid ligands on tetrelchalcogenide cages.

  DOI：

  10.1021/om500014z

文献信息

• NOVEL FLUORINATED ADAMANTANE DERIVATIVE
  申请人：OHARU Kazuya

  公开号：US20070083064A1

  公开（公告）日：2007-04-12

  A compound represented by the formula A F (—COF) n , provided that A F and n have the following meanings. A F : a fluorinated adamantane residue which is an n-valent group having an n number of hydrogen atoms removed from adamantane (provided that when n is at least 2, the removed hydrogen atoms are hydrogen atoms bonded to different carbon atoms), wherein at least one of the remaining hydrogen atoms is substituted by a fluorine atom, and the remaining hydrogen atoms may be substituted by a C 1-6 alkyl group or fluoroalkyl group, and n: an integer of from 1 to 4, provided the when n is 1, A F has at least one hydrogen atom.
• US7425646B2
  申请人：——

  公开号：US7425646B2

  公开（公告）日：2008-09-16
• Diamondoid Hydrazones and Hydrazides: Sterically Demanding Ligands for Sn/S Cluster Design
  作者：Beatrix E. K. Barth、Boryslav A. Tkachenko、Jens P. Eußner、Peter R. Schreiner、Stefanie Dehnen

  DOI：10.1021/om500014z

  日期：2014.4.14

  A series of new adamantane and diamantane hydrazides was synthesized and coupled with organo-functionalized Sn/S clusters of the general type [(RSn4S6)-Sn-I] (R-I = CMe2CH2COMe) to form diamondoid-decorated Sn/S dusters. The new ligand precursors as well as the resulting hybrid compounds were analyzed by NMR spectroscopy, mass spectrometry, and single-crystal X-ray diffraction, and first insights were gained in the installation of sterically highly demanding and at the same time rigid mono-, di-, and trifunctionalized diamondoid ligands on tetrelchalcogenide cages.