1-(3-phenylpropyl)-1H-pyrrole | 850662-61-2

• 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-(3-phenylpropyl)-1H-pyrrole
• 英文别名: 1-(3-Phenylpropyl)pyrrole
• CAS: 850662-61-2
• 化学式: C₁₃H₁₅N
• mdl: MFCD12761688
• 分子量: 185.269
• InChiKey: GOXCLGZMUBXUHA-UHFFFAOYSA-N

物化性质

• 沸点：
  298.9±19.0 °C(Predicted)
• 密度：
  0.94±0.1 g/cm3(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：
  4
• 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：

  1-(1-氧代-3-苯基丙基)-1H-吡咯 在 氯化镍二甲氧基乙烷 、 苯硅烷 作用下， 以 甲苯 为溶剂， 反应 24.0h， 以86%的产率得到1-(3-phenylpropyl)-1H-pyrrole
  参考文献：
  名称：

  镍催化的仲和叔酰胺的还原

  摘要：

  据报道，镍催化的仲和叔酰胺的还原生成胺产物。该转化耐受酰胺底物的广泛变化，在酯和可差向异构的立体中心存在下进行，并可用于实现内酰胺的还原。而且，该方法学提供了一种用于获取医学上相关的α-氘代胺的简单策略。

  DOI：

  10.1021/acs.orglett.7b00683

文献信息

• Organic synthesis via magnetic attraction: benign and sustainable protocols using magnetic nanoferrites
  作者：R. B. Nasir Baig、Rajender S. Varma

  DOI：10.1039/c2gc36455g

  日期：——

  Magnetic nano-catalysts have been prepared using simple modification of iron ferrites. The nm size range of these particles facilitates the catalysis process, as an increased surface area is available for the reaction; the easy separation of the catalysts by an external magnet and their recovery and reuse are additional beneficial attributes. Glutathione bearing nano-ferrites have been used as organocatalysts for the Paal–Knorr reaction and homocoupling of boronic acids. Nanoferrites, post-synthetically modified by ligands, were used to immobilize nanometals (Cu, Pd, Ru, etc.) which enabled the development of efficient, sustainable and green procedures for azide–alkynes-cycloaddition (AAC) reactions, C–S coupling, O-allylation of phenol, Heck-type reactions and hydration of nitriles.

  通过简单修饰铁氧体，已制备出磁性纳米催化剂。这些粒子处于纳米尺寸范围，有助于催化过程，因为反应可利用增加的表面积；外部磁铁易于分离催化剂，并可回收和重复使用，这些是额外的有益特性。负载谷胱甘肽的纳米铁氧体已用作有机催化剂，用于Paal-Knorr反应和硼酸的均偶联。通过配体后合成改性的纳米铁氧体，用于固定纳米金属（铜、钯、钌等），从而实现了高效、可持续和绿色的叠氮-炔烃环加成（AAC）反应、碳-硫偶联、酚的烯丙基化、 Heck型反应和腈的水合反应的方法发展。
• AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME
  申请人：Idemitsu Kosan Co., Ltd.

  公开号：EP2423179A1

  公开（公告）日：2012-02-29

  An aromatic amine derivative represented by the following formula (1): wherein A1 is a substituted or unsubstituted alkyl group, a substituted or unsubstituted aromatic group, a substituted or unsubstituted heterocyclic group or an organic group represented by the following formula (2): wherein X1, X2 and X3 are independently a substituted or unsubstituted aromatic group or a substituted or unsubstituted heterocyclic group; X1 and X2 are linkage groups which are different from each other; and B1, B2 and B3 are independently a substituted or unsubstituted aromatic group or a substituted or unsubstituted heterocyclic group.

  以下是由以下式（1）表示的芳香胺衍生物： 其中A1是取代或未取代的烷基，取代或未取代的芳香基，取代或未取代的杂环基或由以下式（2）表示的有机基： 其中X1、X2和X3分别是取代或未取代的芳香基或取代或未取代的杂环基； X1和X2是彼此不同的连接基；以及 B1、B2和B3分别是取代或未取代的芳香基或取代或未取代的杂环基。
• Magnetic nanoparticle-supported glutathione: a conceptually sustainable organocatalyst
  作者：Vivek Polshettiwar、Babita Baruwati、Rajender S. Varma

  DOI：10.1039/b900784a

  日期：——

  A conceptually novel nanoparticle-supported and magnetically recoverable organocatalyst has been developed, which is readily prepared from inexpensive starting materials in a truly sustainable manner; which catalyzes the Paal–Knorr reaction with high yield in pure aqueous medium that avoids the use of toxic organic solvents, even in the workup step.

  开发了一种概念上新颖的纳米粒子支持和可磁性回收的有机催化剂，该催化剂可以通过真正可持续的方式，利用廉价的原材料轻松制备。它在纯水相介质中催化Paal–Knorr反应，具有高产率，避免了使用有毒有机溶剂，甚至在后处理步骤中也不例外。
• Potassium carbonate as a base for the N-alkylation of indole and pyrrole in ionic liquids
  作者：Yogesh R. Jorapur、Jae Min Jeong、Dae Yoon Chi

  DOI：10.1016/j.tetlet.2006.01.129

  日期：2006.4

  for the N-alkylation of indole and pyrrole using potassium carbonate in 1-n-butyl-3-methylimidazolium tetrafluoroborate [bmim][BF4] as the sustainable reaction media with acetonitrile as the cosolvent is described herein. Our approach provides good yields with alkyl halides as well as sulfonates as the electrophiles. Cesium carbonate was also found to be a consistent base in the N-alkylation. The proposed

  本文描述了使用碳酸钾在1-正丁基-3-甲基咪唑四氟硼酸酯[bmim] [BF 4 ]中作为碳酸钾与吲哚和吡咯的N-烷基化的方法，该方法以乙腈作为助溶剂。我们的方法使用烷基卤化物和磺酸盐作为亲电试剂可获得良好的收率。还发现碳酸铯是N-烷基化反应中的一致碱。所提出的方法简单，温和，易于处理。
• 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。