benzyl 2-cyanophenethylcarbamate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: benzyl 2-cyanophenethylcarbamate
• 英文别名: benzyl N-[2-(2-cyanophenyl)ethyl]carbamate
• 化学式: C₁₇H₁₆N₂O₂
• 分子量: 280.326
• InChiKey: LZMJMPHVPCXJHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  62.1
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  苄氧羰基氨基乙基三氟硼酸钾 、 2-溴苯腈 在 1,1'-双(二苯膦基)二茂铁二氯化钯(II)二氯甲烷复合物 caesium carbonate 作用下， 以 水 、 甲苯 为溶剂， 反应 12.0h， 以70%的产率得到benzyl 2-cyanophenethylcarbamate
  参考文献：
  名称：

  Scope of the Suzuki−Miyaura Aminoethylation Reaction Using Organotrifluoroborates

  摘要：

  Potassium beta-aminoethyltrifluoroborates were prepared in good yields via hydroboration of the corre- sponding enecarbamates using the Snieckus hydroborating reagent. A wide variety of phenethylamines containing a potentially free primary amine after appropriate deprotection have been successfully prepared in good yield using these organotrifluoroborates as partners in Suzuki-Miyaura coupling with aryl bromides, iodides, and triflates.

  DOI：

  10.1021/jo7015955

文献信息

• ALKYLNITRILE QUINOLINES, AS NK-3 RECEPTOR LIGANDS
  申请人：AstraZeneca AB

  公开号：EP1928834A1

  公开（公告）日：2008-06-11
• [EN] ALKYLNITRILE QUINOLINES, AS NK-3 RECEPTOR LIGANDS<br/>[FR] QUINOLEINES D'ALKYLNITRILE UTILISEES COMME LIGANDS DES RECEPTEURS NK-3
  申请人：ASTRAZENECA AB

  公开号：WO2007035157A1

  公开（公告）日：2007-03-29

  [EN] Compounds of Formula (I) wherein R¹, A, ², R³, R⁴, R⁵, n, m and q are as described in the specification, pharmaceutically-acceptable salts, methods of making, pharmaceutical compositions containing and methods for using the same.
  [FR] L'invention a pour objet des composés de formule (I) dans laquelle R¹, A, R², R³, R⁴, R⁵, n, m et q sont tels que définis dans la description, des sels pharmaceutiquement acceptables, des procédés de fabrication, des compositions pharmaceutiques renfermant lesdits composés et des procédés d'utilisation desdits composés.
• Scope of the Suzuki−Miyaura Aminoethylation Reaction Using Organotrifluoroborates
  作者：Gary A. Molander、Ludivine Jean-Gérard

  DOI：10.1021/jo7015955

  日期：2007.10.1

  Potassium beta-aminoethyltrifluoroborates were prepared in good yields via hydroboration of the corre- sponding enecarbamates using the Snieckus hydroborating reagent. A wide variety of phenethylamines containing a potentially free primary amine after appropriate deprotection have been successfully prepared in good yield using these organotrifluoroborates as partners in Suzuki-Miyaura coupling with aryl bromides, iodides, and triflates.