6,6-difluoro-1-iodocyclohex-1-ene | 218629-47-1

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 乙烯基卤化物
• 英文名称: 6,6-difluoro-1-iodocyclohex-1-ene
• 英文别名: Cyclohexene, 6,6-difluoro-1-iodo-；6,6-difluoro-1-iodocyclohexene
• CAS: 218629-47-1
• 化学式: C₆H₇F₂I
• 分子量: 244.023
• InChiKey: VHOJXLXCUXNEDO-UHFFFAOYSA-N

物化性质

• 沸点：
  178.2±40.0 °C(Predicted)
• 密度：
  1.83±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  9
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(三丁基锡烷基)呋喃 、 6,6-difluoro-1-iodocyclohex-1-ene 在 copper(l) iodide 、 二(氰基苯)二氯化钯 、 三(2-呋喃基)膦 作用下， 以 N-甲基吡咯烷酮 为溶剂， 以86%的产率得到6,6-difluoro-1-(2-furyl)cyclohex-1-ene
  参考文献：
  名称：

  Difluorinated analogues of shikimic acid

  摘要：

  Investigations into the quinate to shikimate transformation have been carried out, the results of which have been exploited in the synthesis of a novel difluoromethylene homologue of shikimic acid from (-)-quinic acid. Martin's sulfurane {Ph2S[OC(CF3)(2)Ph](2)} was the reagent of choice for the key dehydration step of this synthesis. The results of investigations into the synthesis of the important natural product analogue, 6,6-difluoroshikimic acid are also reported. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(03)00697-5
• 作为产物：
  描述：

  1-(4-喹啉基)甲胺 在 4 A molecular sieve 、 三氟化硫吗啉 作用下， 以 二氯甲烷 为溶剂， 40.0 ℃ 、1000.0 MPa 条件下， 反应 80.0h， 生成 6,6-difluoro-1-iodocyclohex-1-ene
  参考文献：
  名称：

  Improved Difluorination of Cyclohexenones using Morph-DAST by the Application of Ultra-High Pressure

  摘要：

  已通过氟化吗啉硫三氟化物对相应的环己烯-2-酮在热条件下的作用，制备了2,6-和6,6-二氟取代的α-取代环己烯。通过应用超高压（10-19Kbar），该过程的整体效率得到了显著提升。对该方法的适用范围的研究结果得到了新型氟化化合物的制备：6,6-二氟柠檬烯和3,3-二氟-4-胆甾烯。

  DOI：

  10.1055/s-1997-3224

文献信息

• METAL COMPLEX, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS
  申请人：HASHIMOTO MASASHI

  公开号：US20070259207A1

  公开（公告）日：2007-11-08

  There are provided a metal complex which is used as a novel compound for an organic EL device and an organic light-emitting device which uses the metal complex and has an optical output with high efficiency and high luminance. The novel metal complex has, in a partial structure thereof, a non-aromatic ring structure containing at least one olefin and an alkylene group containing at least one F atom, and an unsaturated heterocyclic ring structure containing at least one nitrogen atom. The organic light-emitting device includes a pair of electrodes including an anode and a cathode and at least one layer including an organic compound and interposed between the pair of electrodes, in which the layer including the organic compound contains a metal complex represented by the following structural formula.
• Difluorinated analogues of shikimic acid
  作者：Lovely Begum、Julian M Box、Michael G.B Drew、Laurence M Harwood、Jane L Humphreys、David J Lowes、Gareth A Morris、Perrine M Redon、Francine M Walker、Roger C Whitehead

  DOI：10.1016/s0040-4020(03)00697-5

  日期：2003.6

  Investigations into the quinate to shikimate transformation have been carried out, the results of which have been exploited in the synthesis of a novel difluoromethylene homologue of shikimic acid from (-)-quinic acid. Martin's sulfurane Ph2S[OC(CF3)(2)Ph](2)} was the reagent of choice for the key dehydration step of this synthesis. The results of investigations into the synthesis of the important natural product analogue, 6,6-difluoroshikimic acid are also reported. (C) 2003 Elsevier Science Ltd. All rights reserved.
• Improved Difluorination of Cyclohexenones using Morph-DAST by the Application of Ultra-High Pressure
  作者：Julian Box、Laurence Harwood、Roger Whitehead

  DOI：10.1055/s-1997-3224

  日期：1997.5

  2,6- and 6,6- difluorinated α-substituted cyclohexenes have been prepared by the action of morpholinosulfur trifluoride on the corresponding cyclohex-2-enones under thermal conditions. The overall efficiency of this process has been significantly improved by the application of ultra high pressure (10-19Kbar). Investigations into the scope of this methodology have resulted in the preparation of the novel fluorinated compounds: 6,6-difluorolimonene and 3,3-difluoro-4-cholestene.

  已通过氟化吗啉硫三氟化物对相应的环己烯-2-酮在热条件下的作用，制备了2,6-和6,6-二氟取代的α-取代环己烯。通过应用超高压（10-19Kbar），该过程的整体效率得到了显著提升。对该方法的适用范围的研究结果得到了新型氟化化合物的制备：6,6-二氟柠檬烯和3,3-二氟-4-胆甾烯。