3-(全氟辛基)丙酰叠氮化物 | 649561-69-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 中文名称: 3-(全氟辛基)丙酰叠氮化物
• 英文名称: 3-(perfluorooctyl)propionyl azide
• 英文别名: 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoyl azide
• CAS: 649561-69-3
• 化学式: C₁₁H₄F₁₇N₃O
• 分子量: 517.145
• InChiKey: GSJYNOURILUFLP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  32
• 可旋转键数：
  9
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.91
• 拓扑面积：
  31.4
• 氢给体数：
  0
• 氢受体数：
  19

反应信息

• 作为反应物：
  描述：

  3-(全氟辛基)丙酰叠氮化物 反应 1.0h， 生成 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-十七氟癸基异氰酸酯
  参考文献：
  名称：

  Synthèse des isocyanates de 2-F-alkyléthyle

  摘要：

  Isocyanates are extremely important compounds in organic synthesis but their preparation is not always easy. One of the most convenient methods uses the acids as intermediates. In the F-alkyl series it it sometimes difficult to obtain them. We have optimized an efficient synthetic route to 2-F-alkylethyl isocyanates.

  DOI：

  10.1016/s0022-1139(00)80183-9
• 作为产物：
  描述：

  2-氨基甲苯-5-磺酸 在 叠氮基三甲基硅烷 、 五氯化磷 作用下， 反应 4.0h， 生成 3-(全氟辛基)丙酰叠氮化物
  参考文献：
  名称：

  Synthèse des isocyanates de 2-F-alkyléthyle

  摘要：

  Isocyanates are extremely important compounds in organic synthesis but their preparation is not always easy. One of the most convenient methods uses the acids as intermediates. In the F-alkyl series it it sometimes difficult to obtain them. We have optimized an efficient synthetic route to 2-F-alkylethyl isocyanates.

  DOI：

  10.1016/s0022-1139(00)80183-9

文献信息

• New fluorous tagging and scavenging reactants and methods of synthesis and use thereof
  申请人：——

  公开号：US20040073054A1

  公开（公告）日：2004-04-15

  The present invention includes methods and compositions for increasing the fluorous nature of an organic compound by reacting it with at least one fluorous compound to produce a fluorous tagged organic compound. The increased fluorous nature of the fluorous tagged organic compound can then be utilized to separate the fluorous organic compound from untagged reagents, reactants, catalysts and/or products derived therefrom. The resultant fluorous tagged organic compound can be subjected to subsequent chemical transformations, wherein the fluorous nature of the tagged compound is utilized to increase the ease of separation of the fluorous tagged organic compound from untagged reagents, reactants, catalysts and/or products derived therefrom, after each chemical transformation. The chemical transformations result in a second fluorous tagged organic compound wherein the fluorous nature of the second fluorous tagged organic compound can then be reduced by removing the fluorous group therefrom, thereby producing a second organic compound that may be employed as a pharmaceutical compound or intermediate, or a combinatorial library component.

  本发明涉及一种通过将有机化合物与至少一种含氟化合物反应以产生带氟标记的有机化合物的方法和组合物。带氟标记的有机化合物的氟性增强可以被用于将带氟的有机化合物与未标记的试剂、反应物、催化剂和/或其衍生物分离开来。所得到的带氟标记的有机化合物可以被用于随后的化学转化，其中标记化合物的氟性被利用来增加将带氟标记的有机化合物与未标记的试剂、反应物、催化剂和/或其衍生物分离的便利性，每次化学转化后都是如此。化学转化的结果是得到第二个带氟标记的有机化合物，其中第二个带氟标记的有机化合物的氟性可以通过去除其氟基来降低，从而产生可以用作药物化合物或中间体或组合库组分的第二个有机化合物。
• Fluorous tagging and scavenging reactants and methods of synthesis and use thereof
  申请人：Zhang Wei

  公开号：US20060128957A1

  公开（公告）日：2006-06-15

  The present invention includes methods and compositions for increasing the fluorous nature of an organic compound by reacting it with at least one fluorous compound to produce a fluorous tagged organic compound. The increased fluorous nature of the fluorous tagged organic compound can then be utilized to separate the fluorous organic compound from untagged reagents, reactants, catalysts and/or products derived therefrom. The resultant fluorous tagged organic compound can be subjected to subsequent chemical transformations, wherein the fluorous nature of the tagged compound is utilized to increase the ease of separation of the fluorous tagged organic compound from untagged reagents, reactants, catalysts and/or products derived therefrom, after each chemical transformation. The chemical transformations result in a second fluorous tagged organic compound wherein the fluorous nature of the second fluorous tagged organic compound can then be reduced by removing the fluorous group therefrom, thereby producing a second organic compound that may be employed as a pharmaceutical compound or intermediate, or a combinatorial library component.

  本发明涉及一种通过将有机化合物与至少一种氟碳化合物反应以产生标记有氟碳基团的有机化合物的方法和组合物。标记有氟碳基团的有机化合物的氟碳性质增强后，可以利用它将氟碳有机化合物与未标记的试剂、反应物、催化剂和/或由其衍生的产物分离开来。所得到的标记有氟碳基团的有机化合物可以进行后续的化学转化，其中使用标记化合物的氟碳性质可以增加从每个化学转化后将标记有氟碳基团的有机化合物与未标记的试剂、反应物、催化剂和/或由其衍生的产物分离的便利性。化学转化产生第二个标记有氟碳基团的有机化合物，然后可以通过去除其中的氟碳基团来降低第二个标记有氟碳基团的有机化合物的氟碳性质，从而产生可用作制药化合物或中间体，或组合化学库组分的第二个有机化合物。
• [EN] FLUOROUS TAGGING AND SCAVENGING REACTANTS AND METHODS OF SYNTHESIS AND USE THEREOF<br/>[FR] NOUVEAU REACTIFS DE MARQUAGE AU FLUOR ET DE PIEGEAGE ET PROCEDES DE SYNTHESE ET D'UTILISATION CORRESPONDANTS
  申请人：FLUOROUS TECHNOLOGIES INC

  公开号：WO2004007407A3

  公开（公告）日：2004-11-25
• US7060850B2
  申请人：——

  公开号：US7060850B2

  公开（公告）日：2006-06-13
• US7576245B2
  申请人：——

  公开号：US7576245B2

  公开（公告）日：2009-08-18