9-acetyl-o-carborane | 68183-94-8

• 英文名称: 9-acetyl-o-carborane
• CAS: 68183-94-8
• 化学式: C₄H₁₄B₁₀O
• 分子量: 186.265
• InChiKey: UNOGBADUDOAGQJ-UHFFFAOYSA-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：

  9-ethynyl-1,2-dicarba-closo-dodecaborane 在 水 、 mercury(II) sulfate 作用下， 以 甲醇 为溶剂， 以53%的产率得到9-acetyl-o-carborane
  参考文献：
  名称：

  Action of electrophilic reagents on 9-ethynyl-o- and 9-ethynyl-m-carboranes

  摘要：

  DOI：

  10.1007/bf00956808

文献信息

• Syntheses and Crystal Structures of 9-Acetyl- and 9-Cyano-1,2-dicarbadodecaborane:  Supramolecular Association in Carboranyl C−H Hydrogen-Bonded α-Networks
  作者：Liliana Crǎciun、Radu Custelcean

  DOI：10.1021/ic9904889

  日期：1999.10.1

  The syntheses and X-ray crystal structures of 9-acetyl-o-carborane (1) and 9-cyano-o-carborane (2) are reported. In the crystal, molecules of 1 and 2 associate in one-dimensional polymeric chains or ct-type hydrogen-bonded networks linked through C-H-carborane... O or C-H-carborane... N hydrogen bonds, which provides further structural evidence for carboranes as a new class of proton donors in hydrogen-bond formation and attests to the ability of carborane moieties to participate in self-assembly processes.