2-dodecylidene-1,3-dithiane | 1126748-76-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二噻烷
• 英文名称: 2-dodecylidene-1,3-dithiane
• 英文别名: 2-Dodecylidene-1,3-dithiane
• CAS: 1126748-76-2
• 化学式: C₁₆H₃₀S₂
• 分子量: 286.546
• InChiKey: QOFUIZMLVQTQSJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.8
• 重原子数：
  18
• 可旋转键数：
  10
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  50.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-dodecylidene-1,3-dithiane 在 tetrafluoroboric acid 、 sodium tetrahydroborate 作用下， 以 乙腈 为溶剂， 反应 0.5h， 以60%的产率得到1-(2-(1,3-dithianyl))dodecane
  参考文献：
  名称：

  Replacing the carbonyl's oxygen with the difluoromethyl group

  摘要：

  Aldehydes or ketones were reacted with 2-(trimethylsilyl)-1,3-dithiane (1) and the products reduced to the corresponding dithianes using tetrafluoroboric acid and sodium borohydride. These sulfur containing Compounds were reacted with bromine trifluoride under mild conditions (1-2 min, 0 C) with a net result of replacing the carbonyls' oxygen with the desired difluoromethyl moiety. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.12.042
• 作为产物：
  描述：

  2-三甲基硅基-1,3-二噻吩 、 十二醛 在 正丁基锂 作用下， 以 四氢呋喃 为溶剂， 反应 5.0h， 以80%的产率得到2-dodecylidene-1,3-dithiane
  参考文献：
  名称：

  Replacing the carbonyl's oxygen with the difluoromethyl group

  摘要：

  Aldehydes or ketones were reacted with 2-(trimethylsilyl)-1,3-dithiane (1) and the products reduced to the corresponding dithianes using tetrafluoroboric acid and sodium borohydride. These sulfur containing Compounds were reacted with bromine trifluoride under mild conditions (1-2 min, 0 C) with a net result of replacing the carbonyls' oxygen with the desired difluoromethyl moiety. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.12.042

文献信息

• Replacing the carbonyl's oxygen with the difluoromethyl group
  作者：Or Cohen、Youlia Hagooly、Shlomo Rozen

  DOI：10.1016/j.tet.2008.12.042

  日期：2009.2

  Aldehydes or ketones were reacted with 2-(trimethylsilyl)-1,3-dithiane (1) and the products reduced to the corresponding dithianes using tetrafluoroboric acid and sodium borohydride. These sulfur containing Compounds were reacted with bromine trifluoride under mild conditions (1-2 min, 0 C) with a net result of replacing the carbonyls' oxygen with the desired difluoromethyl moiety. (C) 2008 Elsevier Ltd. All rights reserved.