3-氨基戊-2-烯腈 | 88239-19-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 3-氨基戊-2-烯腈
• 英文名称: (E)-3-aminopent-2-enenitrile
• CAS: 88239-19-4
• 化学式: C₅H₈N₂
• 分子量: 96.1319
• InChiKey: TVOQXZXCTSAZQF-HWKANZROSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  7
• 可旋转键数：
  1
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  49.8
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-氨基戊-2-烯腈 、 噻唑烷盐酸盐 以 乙腈 为溶剂， 反应 2.0h， 以74%的产率得到5-ethyl-2,3,4,7-tetrahydro[1,4]thiazepine-6-carbonitrile
  参考文献：
  名称：

  Synthesis of 2,3,4,7-tetrahydro[1,4]thiazepines from thiazolidines and β-enaminonitriles

  摘要：

  A wide library of 2,3,4,7-tetrahydrol 1,4]thiazepines have been prepared by simple heating of thiazolidine and beta-enaminonitrile derivatives in acetonitrile. The procedure, whose yields depend on the nature and position of the Substituents, gave good results if the substituents were not very bulky but it is less effective when starting from 2-substituted thiazolidines. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.02.027
• 作为产物：
  描述：

  [(Z)-3-amino-4-cyanobut-3-en-2-yl] acetate 以70%的产率得到
  参考文献：
  名称：

  KOBAYASHI, KAZUHIRO;HIYAMA, TAMEJIRO, TETRAHEDRON LETT., 1983, 24, N 33, 3509-3512

  摘要：

  DOI：

文献信息

• Synthesis of 2,3,4,7-tetrahydro[1,4]thiazepines from thiazolidines and β-enaminonitriles
  作者：Luis A. Calvo、Alfonso González-Ortega、Rocío Marcos、Mónica Pérez、M. Carmen Sañudo

  DOI：10.1016/j.tet.2008.02.027

  日期：2008.4

  A wide library of 2,3,4,7-tetrahydrol 1,4]thiazepines have been prepared by simple heating of thiazolidine and beta-enaminonitrile derivatives in acetonitrile. The procedure, whose yields depend on the nature and position of the Substituents, gave good results if the substituents were not very bulky but it is less effective when starting from 2-substituted thiazolidines. (c) 2008 Elsevier Ltd. All rights reserved.
• KOBAYASHI, KAZUHIRO;HIYAMA, TAMEJIRO, TETRAHEDRON LETT., 1983, 24, N 33, 3509-3512
  作者：KOBAYASHI, KAZUHIRO、HIYAMA, TAMEJIRO

  DOI：——

  日期：——