perfluoro(3-methylinden-1-one) | 146366-30-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: perfluoro(3-methylinden-1-one)
• 英文别名: Perfluoro(3-methylindenone)；Perfluoro-3-methylindenone；2,4,5,6,7-pentafluoro-3-(trifluoromethyl)inden-1-one
• CAS: 146366-30-5
• 化学式: C₁₀F₈O
• 分子量: 288.097
• InChiKey: IIAFMUQLBUZEDK-UHFFFAOYSA-N

物化性质

• 沸点：
  235.2±40.0 °C(Predicted)
• 密度：
  1.73±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  19
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  perfluoro(3-methylinden-1-one) 在 氢氟酸 、 双氧水 、 五氟化锑 作用下， 生成 perfluoro-4-methylcoumarine
  参考文献：
  名称：

  Skeletal transformations of perfluoroisopropyl-benzocycloalkenes under the action of SbF5

  摘要：

  DOI：

  10.1016/s0022-1139(00)83819-1
• 作为产物：
  描述：

  Perfluoro(1-methyleneindane) 在 氯氟磺酰 、 氢氟酸 、 双氧水 、 五氟化锑 作用下， 反应 4.67h， 生成 perfluoro(3-methylinden-1-one)
  参考文献：
  名称：

  Fluoroindenes. 13. Transformations of polyfluorinated indenes and 1-alkylideneindans in the H2O2-HF-SbF5 system

  摘要：

  The reaction of perfluorinated indene, 3-methylindene, and 1-methylene- and 1-ethylideneindans with hydrogen peroxide in the hydrogen fluoride-antimony pentafluoride medium takes place at the multiple bond of the substrate and leads to the oxo derivatives of indan. The process probably takes place through the electrophilic addition of HO+. The C=C bond in perfluoro-3-methylindenone is not affected. In this compound and also in perfluoro-2-indanone and perfluoro-1-methyl-2-indanone the carbonyl group is involved in reaction with hydrogen peroxide in the HF-SbF5 system, and six-membered oxygen-containing heterocyclic compounds are formed.

  DOI：

  10.1007/bf00866597

文献信息

• Transformation of perfluorinated benzocycloalkenes and alkylbenzenes to their carbonyl derivatives under the action of CF3COOH/SbF5
  作者：Yaroslav V. Zonov、Victor M. Karpov、Vyacheslav E. Platonov

  DOI：10.1016/j.jfluchem.2007.05.020

  日期：2007.9

  Perfluorinated benzocycloalkenes (benzocyclobutene, indan, tetralin), alkylbenzocycloalkenes and alkylbenzenes react with CF3COOH/SbF5 at 20-50 degrees C giving the corresponding carbonyl derivatives. (c) 2007 Elsevier B.V. All rights reserved.
• Karpov; Platonov; Chuikov, Russian Journal of Organic Chemistry, 1999, vol. 35, # 1, p. 80 - 84
  作者：Karpov、Platonov、Chuikov、Shchegoleva

  DOI：——

  日期：——