4-iodotricyclene | 82005-23-0

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 有机碘化物
• 英文名称: 4-iodotricyclene
• 英文别名: 4-Iodo-1,7,7-trimethyltricyclo[2.2.1.02,6]heptane
• CAS: 82005-23-0
• 化学式: C₁₀H₁₅I
• 分子量: 262.134
• InChiKey: GLUMDIUHMSNHLZ-UHFFFAOYSA-N

物化性质

• 熔点：
  90-90.5 °C
• 沸点：
  222.2±9.0 °C(Predicted)
• 密度：
  1.63±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  4-iodotricyclene 在 二氟代氙 作用下， 以 四氯化碳 为溶剂， 反应 1.0h， 生成 4-(difluoroiodo)tricyclene
  参考文献：
  名称：

  4-(Difluoroiodo)tricyclene, an isolable compound of type RIF2 from an aliphatic iodide

  摘要：

  The synthesis, characterisation and reactivity are reported for the title compound which is the first isolable compound of type RIF2 from an aliphatic iodide.

  DOI：

  10.1039/p19920003001
• 作为产物：
  描述：

  4-tricyclyliodonium bis(m-chlorobenzoate) 、 sodium hydroxide 以50%的产率得到
  参考文献：
  名称：

  MORRIS, D. G.;SHEPHERD, A. G., J. CHEM. SOC. CHEM. COMMUN., 1981, N 24, 1250-1251

  摘要：

  DOI：

文献信息

• 4-Tricyclyliodonium bis(m-chlorobenzoate): a stable aliphatic trivalent iodine diester
  作者：David G. Morris、Alistair G. Shepherd

  DOI：10.1039/c39810001250

  日期：——

  The first saturated aliphatic trivalent iodine diester and the rationale on which the synthesis is based are described.

  描述了第一饱和脂族三价碘二酯和合成所基于的原理。
• Unusual synthesis and crystal structure of 4-tricyclanol
  作者：David G. Morris、Karl S. Ryder、Shirley Walker、Kenneth W. Muir、Gary B. Hix、Elizabeth J. Maclean

  DOI：10.1016/s0040-4039(00)01903-1

  日期：2001.1

  Here we report the synthesis of 4-tricyclanol, 6, via an unusual route and its characterisation, by single crystal X-ray diffraction studies. The crystal structure of 6 shows extended hydrophobic channels and catenated hydrogen bonding. Both of these structural features are, to our knowledge, unique in multicyclic cage alcohols. The structures of similar compounds such as 1-adamantanol and cis-verbinol are based on small aggregate hydrogen-bonded clusters. We propose that the catenated hydrogen-bonded structure of the crystal phase of the title compound leads to the unusual morphology of the crystalline sample. Whereas crystals of other multicyclic cage alcohols are typically cuboid in shape, those of 4-tricyclanol, are very long (20-30 mm) needles with Rat rectangular cross-sections (1-2 x 0.3 mm). The long axis of these crystals extends in the direction of the catenated hydrogen bonding. (C) 2000 Elsevier Science Ltd. All rights reserved.