1-(2-phenylpropyl)-1H-pyrrole | 1197029-64-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 1-(2-phenylpropyl)-1H-pyrrole
• 英文别名: 1-(2-Phenylpropyl)pyrrole
• CAS: 1197029-64-3
• 化学式: C₁₃H₁₅N
• mdl: MFCD26794537
• 分子量: 185.269
• InChiKey: RHPVEXUOCZEXNL-UHFFFAOYSA-N

物化性质

• 沸点：
  287.3±19.0 °C(predicted)
• 密度：
  0.95±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  4.9
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  3-吡咯啉 、 2-苯基丙醛 在 苯甲酸 作用下， 以 甲苯 为溶剂， 反应 12.0h， 以88%的产率得到1-(2-phenylpropyl)-1H-pyrrole
  参考文献：
  名称：

  Formation of N-Alkylpyrroles via Intermolecular Redox Amination

  摘要：

  A wide variety of aldehydes, ketones, and lactols undergo redox amination when allowed to react with 3-pyrroline in the presence of a mild Bronsted acid catalyst. This reaction utilizes the inherent reducing power of 3-pyrroline to perform the equivalent of a reductive amination to form alkyl pyrroles. In doing so, the reaction avoids stoichiometric reducing agents that are typically associated with reductive aminations. Moreover, the redox amination protocol allows access to alkyl. pyrroles that cannot be made via standard reductive amination.

  DOI：

  10.1021/ja907357g

文献信息

• Decarboxylative formation of N-alkyl pyrroles from 4-hydroxyproline
  作者：Indubhusan Deb、Daniel J. Coiro、Daniel Seidel

  DOI：10.1039/c1cc11560j

  日期：——

  N-Alkyl pyrroles are obtained in a single step from 4-hydroxyproline and aldehydes in just 15 min under microwave irradiation.

  在微波辐射下，仅用15分钟即可从4-羟基脯氨酸和醛一步获得N-烷基吡咯。
• ORGANIC ELECTROLUMINESCENCE MATERIAL AND ELECTROLUMINESCENCE DEVICE USING THE SAME
  申请人：Tada Hiroshi

  公开号：US20060263639A1

  公开（公告）日：2006-11-23

  An organic electroluminescence material of the present invention includes, in order to provide an durable organic EL device emitting light of high brightness, a compound shown by the general formula (A-I) or (B-I) (as explained in the specification) wherein, A 1 to A 3 which may be the same or different, are independently each a substituent shown by the general formula (A-II) (as explained in the specification): and a 1 , b 1 , and b 2 are independently each an aryl group which may be substituted, a 1 having at least one substituent shown by the general formula (B-II) (as explained in the specification), and b 1 and b 2 each having at least one substituent shown by the general formula (B-III) (as explained in the specification), and b 1 and b 2 may be the same of different.

  本发明的有机电致发光材料包括化合物，以提供一种持久的有机EL器件，该器件发出高亮度的光，所述化合物由通式（A-I）或（B-I）（在规范中解释）所示的化合物组成，其中A1至A3可以相同或不同，分别独立地是由通式（A-II）（在规范中解释）所示的取代基，而a1，b1和b2则分别是可以被取代的芳基，其中a1至少具有由通式（B-II）（在规范中解释）所示的一个取代基，而b1和b2分别具有由通式（B-III）（在规范中解释）所示的一个或多个取代基，且b1和b2可以相同或不同。