3-methylthiopyrrolidino[1,2-c]thiazolidin-3-ylium iodide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑啉类
• 英文名称: 3-methylthiopyrrolidino[1,2-c]thiazolidin-3-ylium iodide
• 英文别名: (7aS)-3-methylsulfanyl-5,6,7,7a-tetrahydro-1H-pyrrolo[1,2-c][1,3]thiazol-4-ium;iodide
• 化学式: C₇H₁₂NS₂*I
• 分子量: 301.215
• InChiKey: WFISEBZYJPEQOD-RGMNGODLSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -1.37
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  53.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-methylthiopyrrolidino[1,2-c]thiazolidin-3-ylium iodide 在 tetraphosphorus decasulfide 作用下， 以 甲苯 为溶剂， 生成 (S)-3-thia-1-azabicyclo[3.3.0]octane-2-thione
  参考文献：
  名称：

  Kinetic resolution of secondary alcohols using proline-derived bicyclic iminium salts

  摘要：

  DOI：

  10.1016/s0040-4039(97)00815-0
• 作为产物：
  描述：

  L-脯氨醇 在 sodium hydroxide 作用下， 以 水 为溶剂， 生成 3-methylthiopyrrolidino[1,2-c]thiazolidin-3-ylium iodide
  参考文献：
  名称：

  Synthesis and structure of highly polarised double-bond compounds derived from S-proline

  摘要：

  Reaction of the chiral iminium salt 3 with stabilised carbanions gives the compounds 4-9 containing a highly polarised double bond. The extent of this polarisation is determined by variable temperature H-1 NMR studies, comparison of C-13 NMR chemical shifts and an X-ray structure determination. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)01372-1

文献信息

• Aitken, R. Alan; Armstrong, David P.; Galt, Ronald H. B., Journal of the Chemical Society. Perkin transactions I, 1997, # 14, p. 2139 - 2145
  作者：Aitken, R. Alan、Armstrong, David P.、Galt, Ronald H. B.、Mesher, Shaun T. E.

  DOI：——

  日期：——
• Yadav, L D S; Sharma, Sangeeta; Vaish, Anjum, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1992, vol. 31, # 9, p. 604 - 605
  作者：Yadav, L D S、Sharma, Sangeeta、Vaish, Anjum

  DOI：——

  日期：——
• Synthesis, structure and nonlinear optical properties of some chiral chromophores derived from l-proline
  作者：Richard D.A Hudson、Anthony R Manning、John F Gallagher、Maria-Helena Garcia、Nelson Lopes、Inge Asselberghs、Roel Van Boxel、Andre Persoons

  DOI：10.1016/s0040-4039(02)02005-1

  日期：2002.11

  A series of chiral donor-pi-acceptor chromophores with potential for nonlinear optical activity has been synthesised utilising a donor derived from L-proline as the source of chirality. The compounds feature both organic and organometallic acceptor end groups and were assessed for second harmonic generation by the Kurtz powder technique and in one case by hyper-Raleigh scattering. (C) 2002 Elsevier Science Ltd. All rights reserved.