| 1208125-31-8

• CAS: 1208125-31-8
• 化学式: BF₄*C₂₇H₄₅BFeN₉O₆
• 分子量: 745.174
• InChiKey: YQMOBLTZYYUKBI-RGJLCZDOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  (Z)-1-diisopropoxyboryl-2-methylpenta-1,4-diene 在 Et₃N 作用下， 以 乙腈 为溶剂， 生成
  参考文献：
  名称：

  Template synthesis, structure and spectra of the semiclathrochelate and clathrochelate 1,4-pentadienylboron-capped iron(II) oximehydrazonates

  摘要：

  The direct template condensation of diacetylmonooxime hydrazone with the 1,4-pentadienylboronates as Lewis acids on an iron(II) ion matrix led to the 1,4-pentadienylboron-capped semiclathrochelate iron(II) oximehydrazonates. The H+-ion-catalyzed macrocyclization of these precursors with an excess of triethyl orthoformate resulted in macrobicyclic complexes with a single apical 1,4-pentadienyl substituent. The complexes obtained were characterized using elemental analysis, MALDI-TOF mass spectrometry, IR, UV-Vis, H-1, B-11{H-1} and C-13{H-1} NMR, Fe-57 Mossbauer spectroscopies, and X-ray crystallography. The X-ray diffraction and NMR data for complexes obtained showed the syn,syn,syn-orientation of all ethoxy substituents in 1,3,5-triazacyclohexane capping fragment in relation to a clathrochelate framework. (C) 2009 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2009.11.005