2-ethylsulfanyl-1,2-diphenyl-ethanone | 16222-12-1

• 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: 2-ethylsulfanyl-1,2-diphenyl-ethanone
• 英文别名: α-ethylsulfanyl-deoxybenzoin；α-Aethylmercapto-desoxybenzoin；α-Phenyl-α-ethylthioacetophenon；α-(Ethylthio)deoxybenzoin；Desylethylsulfid；2-ethylsulfanyl-1,2-diphenylethanone
• CAS: 16222-12-1
• 化学式: C₁₆H₁₆OS
• 分子量: 256.368
• InChiKey: HIJOFCXOSFOOOM-UHFFFAOYSA-N

物化性质

• 熔点：
  78 °C
• 沸点：
  383.1±30.0 °C(Predicted)
• 密度：
  1.117±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.36
• 重原子数：
  18.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  17.07
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  2-ethylsulfanyl-1,2-diphenyl-ethanone 以83%的产率得到2-ethylsulfanyl-1,2-diphenyl-ethanol
  参考文献：
  名称：

  Chemical Oxidation Studies of β-Hydroxy-sulfides withtris(4-Bromophenyl)aminium Hexachloroantimonate: Diastereoselective Sulfoxide Obtaining and Pinacol-Type Rearrangement

  摘要：

  The chemical oxidation of some beta-hydroxy-sulfides in the presence of tris(4-bromo-phenyl)aminium hexachloroantimonate (TBPA) is reported. The oxidation of 2-ethylsulfanyl-cyclohexan-1-ol (cis- and trans-) resulted the corresponding sulfoxides with good diastereoselectivity (d.e.; approximate to50%) and for 2-methyl-2-ethylsulfanyl-cyclohexan-1-ol and 2-ethylsulfanyl-1,2-diphenyl-ethanol, the corresponding nonsulfanylated ketones (61-75%) and ethyl ethanethiolsulfonate (51-65%) were obtained via oxidative cleavage and pinacol-type rearrangement.

  DOI：

  10.1081/scc-120018767
• 作为产物：
  描述：

  安息香精油 生成 2-ethylsulfanyl-1,2-diphenyl-ethanone
  参考文献：
  名称：

  Chemical Oxidation Studies of β-Hydroxy-sulfides withtris(4-Bromophenyl)aminium Hexachloroantimonate: Diastereoselective Sulfoxide Obtaining and Pinacol-Type Rearrangement

  摘要：

  The chemical oxidation of some beta-hydroxy-sulfides in the presence of tris(4-bromo-phenyl)aminium hexachloroantimonate (TBPA) is reported. The oxidation of 2-ethylsulfanyl-cyclohexan-1-ol (cis- and trans-) resulted the corresponding sulfoxides with good diastereoselectivity (d.e.; approximate to50%) and for 2-methyl-2-ethylsulfanyl-cyclohexan-1-ol and 2-ethylsulfanyl-1,2-diphenyl-ethanol, the corresponding nonsulfanylated ketones (61-75%) and ethyl ethanethiolsulfonate (51-65%) were obtained via oxidative cleavage and pinacol-type rearrangement.

  DOI：

  10.1081/scc-120018767

文献信息

• The Alkaline Cleavage of Desyl Thioethers
  作者：Sylvia Teich、David Y. Curtin

  DOI：10.1021/ja01162a035

  日期：1950.6