3-Benzoyl-cyclopentanecarbaldehyde | 62732-17-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-Benzoyl-cyclopentanecarbaldehyde
• 英文别名: 3-Benzoylcyclopentane-1-carbaldehyde
• CAS: 62732-17-6
• 化学式: C₁₃H₁₄O₂
• 分子量: 202.253
• InChiKey: QYOWBEDMFGCYFY-UHFFFAOYSA-N

物化性质

• 沸点：
  328.9±35.0 °C(Predicted)
• 密度：
  1.173±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1,3-二碘丙烷 、 3-hydroxoperoxy-2-phenyl-2-norbornyl hydroperoxide 在 silver(l) oxide 作用下， 以 二氯甲烷 为溶剂， 反应 16.0h， 以9%的产率得到2-phenyl-3,4,8,9-tetraoxatricyclo[9.2.1.0(2,10)]tetradecane
  参考文献：
  名称：

  Synthesis, crystal structure and antimalarial activity of novel 1,2,5,6-tetraoxacycloalkanes from 2,3-dihydroperoxy-2-phenylnorbornane

  摘要：

  Photooxygenation of 2-phenylnorbornene 1 in the presence of 30% aqueous hydrogen peroxide in acetonitrile afforded the labile 1,2-bis-hydroperoxide 3 which could be cycloalkylated to provide the tricyclic peroxides 5, albeit in low yield, on treatment with silver oxide and a 1,omega-diiodoalkane. Trimethylsilylation of 3, followed by TMSOTf-catalyzed cyclocondensation with carbonyl compounds led to the formation of the tricyclic peroxides 8 containing a 1,2,4,5-tetroxepane structure. The structures of two novel tricyclic peroxides 5a and 8a were unambiguously determined by the X-ray crystallographic analysis. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)01944-9