2-methylallyl 2-methylpropanedithioate | 67230-71-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫代羰基化合物
• 英文名称: 2-methylallyl 2-methylpropanedithioate
• 英文别名: 2-Methylprop-2-enyl 2-methylpropanedithioate
• CAS: 67230-71-1
• 化学式: C₈H₁₄S₂
• 分子量: 174.331
• InChiKey: DOYWROFGTJVXJM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  10
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  57.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-methylallyl 2-methylpropanedithioate 在 间氯过氧苯甲酸 作用下， 生成 Isopropyl(methallylthio)sulfine
  参考文献：
  名称：

  Intramolecular cyclization of (allylthio)sulfines via their vinylsulfenic acid tautomers.

  摘要：

  Intramolecular cyclization of enethiolizable (allylthio)sulfines afford 2-alkylidene-1,3-dithiolane-1-oxides in good yields. The formation of these compounds can be explained by an initial tautomerization of the sulfine to vinyl sulfenic acid, followed by an intramolecular addition of the sulfenic acid to the allylic double bond. The structures of the products were elucidated by means of H-1-and C-13-NMR spectroscopy as well as LIS effects, deuteriation experiments and an X-my analysis.

  DOI：

  10.1016/s0040-4039(00)60979-6
• 作为产物：
  描述：

  3-溴-2-甲基丙烯 以83%的产率得到
  参考文献：
  名称：

  SCHOUFS M.; VERMEER P.; MEIJER J.; BRANDSMA L., SYNTHESIS, 1978, NO 6, 439-440

  摘要：

  DOI：

文献信息

• Synthesis of γ,δ-Unsaturated Dithioacids, 1-Alkenyl Alkanedithioates, and γ-Dithiolactones from 2-Alkenyl Alkanedithioates
  作者：M. SCHOUFS、J. MEIJER、P. VERMEER、L. BRANDSMA

  DOI：10.1055/s-1978-24772

  日期：——
• Mazzanti Germana, van Helvoirt Esther, van Vliet Leonard A., Ruinaard Ren+, J. Chem. Soc. Perkin Trans. 1, (1994) N 22, S 3299-3304
  作者：Mazzanti Germana, van Helvoirt Esther, van Vliet Leonard A., Ruinaard Ren+

  DOI：——

  日期：——
• Intramolecular cyclization of (allylthio)sulfines via their vinylsulfenic acid tautomers.
  作者：Germana Mazzanti、René Ruinaard、Leonard A. Van Vliet、Paolo Zani、Bianca F. Bonini、Binne Zwanenburg

  DOI：10.1016/s0040-4039(00)60979-6

  日期：1992.10

  Intramolecular cyclization of enethiolizable (allylthio)sulfines afford 2-alkylidene-1,3-dithiolane-1-oxides in good yields. The formation of these compounds can be explained by an initial tautomerization of the sulfine to vinyl sulfenic acid, followed by an intramolecular addition of the sulfenic acid to the allylic double bond. The structures of the products were elucidated by means of H-1-and C-13-NMR spectroscopy as well as LIS effects, deuteriation experiments and an X-my analysis.
• SCHOUFS M.; VERMEER P.; MEIJER J.; BRANDSMA L., SYNTHESIS, 1978, NO 6, 439-440
  作者：SCHOUFS M.、 VERMEER P.、 MEIJER J.、 BRANDSMA L.

  DOI：——

  日期：——