1,2-diphenylethyl radical | 36877-87-9

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: 1,2-diphenylethyl radical
• 英文别名: 1,2-diphenylethane radical；1,2-diphenyl-ethyl；1,2-Diphenylethyl-Radikal；Diphenylethylradikal；1,2-Diphenyl-1-ethyl
• CAS: 36877-87-9
• 化学式: C₁₄H₁₃
• 分子量: 181.257
• InChiKey: IIJYIXCPHJPZPP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 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：

  1,2-diphenylethyl radical 生成 1,2,3,4-四苯基丁烷
  参考文献：
  名称：

  1,2-二苯乙烷的液相热解

  摘要：

  DOI：

  10.1021/j150605a025
• 作为产物：
  描述：

  1,2-二苯乙烷 在 1,2,3-三苯基丙烷 作用下， 生成 1,2-diphenylethyl radical
  参考文献：
  名称：

  1,2-二苯乙烷的液相热解

  摘要：

  DOI：

  10.1021/j150605a025

文献信息

• One-electron oxidation of alkylbenzenes in acetonitrile by photochemically produced nitrate radical: evidence for an inner-sphere mechanism
  作者：Tiziana Del Giacco、Enrico Baciocchi、Steen Steenken

  DOI：10.1021/j100123a003

  日期：1993.5

  The reaction between NO3. and polyalkylbenzenes was studied using 308-nm laser flash photolysis of cerium(IV) ammonium nitrate in the presence of the alkylbenzenes in acetonitrile solution. For all benzenes, with the exception of monoalkylbenzenes and o- and m-xylene, the reaction with NO3. was found to yield the corresponding radical cations and to proceed in an apparently straightforward bimolecular manner. For monoalkylbenzenes and o- and m-xylene, radicals were seen which are derived from the parents by formal loss of H. from the side chain of the aromatic. This reaction proceeds via a complex between the aromatic and NO3. with the decomposition of the complex being rate determining at higher concentrations of aromatic (rate constants for decomposition between 6 x 10(5) and 4 x 10(7) s-1). In the complex, electron transfer from the aromatic to NO3. is suggested to be concerted with deprotonation of the incipient radical cation. Formation of a complex between NO3. and aromatic is likely even in those cases where radical cations are observed, with the assumption that in these cases the complex decomposition rate is greater-than-or-equal-to 6 x 10(7) s-1.
• Norman; Porter, Proceedings of the Royal Society of London, Series A: Mathematical, Physical and Engineering Sciences, 1955, vol. 230, p. 399,411
  作者：Norman、Porter

  DOI：——

  日期：——
• Denisov, Russian Journal of Physical Chemistry, 1996, vol. 70, # 2, p. 238 - 241
  作者：Denisov

  DOI：——

  日期：——
• Frisch, S.; Hippler, H.; Troe, J., Zeitschrift fur Physikalische Chemie, 1995, vol. 188, # 1, p. 259 - 274
  作者：Frisch, S.、Hippler, H.、Troe, J.

  DOI：——

  日期：——
• Phenyl radical kinetics
  作者：J. C. Scaiano、L. C. Stewart

  DOI：10.1021/ja00349a043

  日期：1983.6