4-(二环己基氨基)苯甲腈 | 1041558-56-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 4-(二环己基氨基)苯甲腈
• 英文名称: 4-(dicyclohexylamino)benzonitrile
• CAS: 1041558-56-8
• 化学式: C₁₉H₂₆N₂
• 分子量: 282.429
• InChiKey: YJGUQPWWUDWZJD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  27
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  对氯苯甲腈 、 二环己胺 在 正丁基锂 、 氯化铵 作用下， 以 四氢呋喃 、 正己烷 、 水 为溶剂， 反应 1.25h， 以32%的产率得到3-(dicyclohexylamino)benzonitrile
  参考文献：
  名称：

  Synthesis of N,N-dialkylaminobenzonitriles and halo-(N,N-dialkyl)benzamidines by reaction of halobenzonitriles with lithium amides

  摘要：

  3- and 4-N,N-Dialkylaminobenzonitriles and 4-chloro-(N,N-dialkyl)benzamidines were isolated by reacting 4-chlorobenzonitrile with hindered lithium amides under thermodynamic (0 degrees C) and kinetic control conditions (-78 degrees C), respectively. As previously reported, a benzyne mechanism seems to be confirmed since N,N-dialkylaminobenzonitriles are formed. Only benzamidines were isolated in fair to high yields at both 0 degrees C and -78 degrees C with non-hindered lithium amides. Exploitation and mechanistic rationale of the reaction of different halobenzonitriles are also reported. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.06.066

文献信息

• POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS COMTAINING A PROTECTED AMINO GROUP
  申请人：Luo Steven

  公开号：US20120059112A1

  公开（公告）日：2012-03-08

  A method for preparing a functionalized polymer, the method comprising the steps of (i) polymerizing monomer with a coordination catalyst to form a reactive polymer; and (ii) reacting the reactive polymer with a nitrile compound containing a protected amino group.

  一种制备功能化聚合物的方法，包括以下步骤：(i)使用配位催化剂聚合单体以形成反应性聚合物；(ii)将反应性聚合物与含有受保护氨基团的腈化合物反应。
• POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP
  申请人：BRIDGESTONE CORPORATION

  公开号：US20130085227A1

  公开（公告）日：2013-04-04

  A method for preparing a functionalized polymer, the method comprising the steps of polymerizing monomer with a coordination catalyst to form a reactive polymer and reacting the reactive polymer with a nitrile compound containing a protected amino group.

  一种制备功能化聚合物的方法，包括以下步骤：使用配位催化剂聚合单体以形成反应性聚合物，并将反应性聚合物与含有受保护氨基团的腈化合物反应。
• US8344066B2
  申请人：——

  公开号：US8344066B2

  公开（公告）日：2013-01-01
• US8735494B2
  申请人：——

  公开号：US8735494B2

  公开（公告）日：2014-05-27
• [EN] POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP<br/>[FR] POLYMÈRES FONCTIONNALISÉS AVEC DES COMPOSÉS DE NITRILE CONTENANT UN GROUPE AMINO PROTÉGÉ
  申请人：BRIDGESTONE CORP

  公开号：WO2010085622A2

  公开（公告）日：2010-07-29

  A method for preparing a functionalized polymer, the method comprising the steps of (i) polymerizing monomer with a coordination catalyst to form a reactive polymer; and (ii) reacting the reactive polymer with a nitrile compound containing a protected amino group.