(Z)-1,1,1-Trifluoro-4-(pyridin-2-ylamino)-but-3-en-2-one | 102145-86-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: (Z)-1,1,1-Trifluoro-4-(pyridin-2-ylamino)-but-3-en-2-one
• 英文别名: (Z)-1,1,1-trifluoro-4-(pyridin-2-ylamino)but-3-en-2-one
• CAS: 102145-86-8
• 化学式: C₉H₇F₃N₂O
• 分子量: 216.163
• InChiKey: BMFLKKKITKQHIR-XQRVVYSFSA-N

物化性质

• 熔点：
  78-79 °C
• 沸点：
  236.4±40.0 °C(Predicted)
• 密度：
  1.361±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  42
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  cobalt(II) chloride hexahydrate 、 (Z)-1,1,1-Trifluoro-4-(pyridin-2-ylamino)-but-3-en-2-one 在 三乙胺 作用下， 以 二氯甲烷 、 甲醇 为溶剂， 反应 2.17h， 生成
  参考文献：
  名称：

  8-Aminoquinoline and 2-aminopyridine trifluoromethyl-derived enaminone ligands and their Co(II), Ni(II) and Zn(II) metal complexes: Structural arrangements due to F⋯H interactions

  摘要：

  Two tridentate trifluoromethylated enaminones derived from 8-aminoquinoline and 2-aminopyridine L1H and L2H have been designed as ligands that can exhibit multiple coordination centers. Five new complexes 1-5 based on transition metals (Co-II. Ni-II and Zn-II) were prepared and their crystal structure and redox properties have been studied. The role of the trifluoromethyl moieties and their ability to form F center dot center dot center dot H intra- and inter-complexes bonds leading to multidimensional networks have been also featured. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2013.06.009
• 作为产物：
  描述：

  2-氨基吡啶 、 (Z)-4-乙氧基-1,1,1-三氟-3-丁烯-2-酮 以 乙腈 为溶剂， 反应 5.0h， 生成 (Z)-1,1,1-Trifluoro-4-(pyridin-2-ylamino)-but-3-en-2-one
  参考文献：
  名称：

  8-Aminoquinoline and 2-aminopyridine trifluoromethyl-derived enaminone ligands and their Co(II), Ni(II) and Zn(II) metal complexes: Structural arrangements due to F⋯H interactions

  摘要：

  Two tridentate trifluoromethylated enaminones derived from 8-aminoquinoline and 2-aminopyridine L1H and L2H have been designed as ligands that can exhibit multiple coordination centers. Five new complexes 1-5 based on transition metals (Co-II. Ni-II and Zn-II) were prepared and their crystal structure and redox properties have been studied. The role of the trifluoromethyl moieties and their ability to form F center dot center dot center dot H intra- and inter-complexes bonds leading to multidimensional networks have been also featured. (C) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2013.06.009

文献信息

• GERUS, I. I.;GORBUNOVA, M. G.;VDOVENKO, S. I.;YAGUPOLSKIJ, YU. L.;KUXAR, +, ZH. ORGAN. XIMII, 26,(1990) N, S. 1877-1883
  作者：GERUS, I. I.、GORBUNOVA, M. G.、VDOVENKO, S. I.、YAGUPOLSKIJ, YU. L.、KUXAR, +

  DOI：——

  日期：——