Phenyl Phenylmethanethiosulfinate | 78609-87-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Phenyl Phenylmethanethiosulfinate
• 英文别名: S-Phenyl phenylmethanesulfinothioate；phenylsulfanylsulfinylmethylbenzene
• CAS: 78609-87-7
• 化学式: C₁₃H₁₂OS₂
• 分子量: 248.37
• InChiKey: JBXLIWMGQOYLRF-UHFFFAOYSA-N

物化性质

• 沸点：
  431.6±38.0 °C(Predicted)
• 密度：
  1.29±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  61.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  Phenyl Phenylmethanethiosulfinate 在 间氯过氧苯甲酸 作用下， 以 氘代氯仿 为溶剂， 以7%的产率得到苯甲磺酸
  参考文献：
  名称：

  Intermediates in the peroxy acid oxidation of phenyl phenylmethanethiosulfinate

  摘要：

  DOI：

  10.1021/jo00333a011
• 作为产物：
  描述：

  phenylmethanesulfinyl chloride 、 苯硫酚 在 吡啶 作用下， 以 乙醚 为溶剂， 反应 0.5h， 以46%的产率得到Phenyl Phenylmethanethiosulfinate
  参考文献：
  名称：

  Chemical ionization and electron impact mass spectra of thiosulfinates, thiosulfonates and sulfinyl sulfones

  摘要：

  AbstractThe chemical ionization and electron impact mass spectra of some thiosulfinates, thiosulfonates and sulfinyl sulfones have been studied. The electron impact mass spectra of four of the six thiosulfonates show molecular ions of less than 1%. Inconclusive evidence was obtained for sulfenyl sulfinate type intermediates in the electron impact spectra of thiosulfonates. The electron impact spectra of thiosulfonates were similar to those of thiosulfonates. The chemical ionization (isobutane) mass spectra of thiosulfinates and thiosulfonates generally show protonated molecular ions [MH]+as base peaks and [MH+1]+and [MH+2]+peaks.

  DOI：

  10.1002/oms.1210170303

文献信息

• A General, high-yield preparation of thiosulfinate esters using organotin precursors
  作者：David N. Harpp、T. Aida、T.H. Chan

  DOI：10.1016/s0040-4039(00)88389-6

  日期：1983.1
• Formation of elusive vic-disulfoxides and OS-sulfenyl sulfinates during the m-chloroperoxybenzoic acid (MCPBA) oxidation of alkyl aryl disulfides and their regioisomeric sulfinothioic acid S-esters
  作者：Fillmore Freeman、Christos N. Angeletakis

  DOI：10.1021/jo00206a013

  日期：1985.3
• HARPP, D. N.;AIDA, T.;CHAN, T. H., TETRAHEDRON LETT., 1983, 24, N 47, 5173-5176
  作者：HARPP, D. N.、AIDA, T.、CHAN, T. H.

  DOI：——

  日期：——
• Intermediates in the peroxy acid oxidation of phenyl phenylmethanethiosulfinate
  作者：Fillmore Freeman、Christos N. Angeletakis

  DOI：10.1021/jo00333a011

  日期：1981.9
• Chemical ionization and electron impact mass spectra of thiosulfinates, thiosulfonates and sulfinyl sulfones
  作者：Fillmore Freeman、Christos N. Angeletakis

  DOI：10.1002/oms.1210170303

  日期：1982.3

  AbstractThe chemical ionization and electron impact mass spectra of some thiosulfinates, thiosulfonates and sulfinyl sulfones have been studied. The electron impact mass spectra of four of the six thiosulfonates show molecular ions of less than 1%. Inconclusive evidence was obtained for sulfenyl sulfinate type intermediates in the electron impact spectra of thiosulfonates. The electron impact spectra of thiosulfonates were similar to those of thiosulfonates. The chemical ionization (isobutane) mass spectra of thiosulfinates and thiosulfonates generally show protonated molecular ions [MH]+as base peaks and [MH+1]+and [MH+2]+peaks.