Methyl-3-cyanpyrrolo<2.1-α>isoquinolin-1-carboxylat | 34971-13-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: Methyl-3-cyanpyrrolo<2.1-α>isoquinolin-1-carboxylat
• 英文别名: 3-cyano-pyrrolo[2,1-a]isoquinoline-1-carboxylic acid methyl ester；Methyl 3-cyanopyrrolo[2,1-a]isoquinoline-1-carboxylate
• CAS: 34971-13-6
• 化学式: C₁₅H₁₀N₂O₂
• 分子量: 250.257
• InChiKey: DSLMBIIXDMCCHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  54.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  Methyl-3-cyanpyrrolo<2.1-α>isoquinolin-1-carboxylat 在 一水合肼 作用下， 生成 3-cyano-pyrrolo[2,1-a]isoquinoline-1-carboxylicacid hydrazide
  参考文献：
  名称：

  Two fluorescence turn-on chemosensors based on pyrrolo[2,1-a]isoquinoline for detection of Ag+ in aqueous solution

  摘要：

  In this study, two water-soluble fluorescent probes based on pyrrolo[2,1-a]isoquinoline derivatives (4a and 4b) were synthesized and characterized by IR, H-1 NMR, C-13 NMR, MS spectra and elemental analysis for the first time. The obtained compounds (4a and 4b) showed fluorescent 'turn-on' phenomenon to Ag+ with limits of detection (LOD) of 0.6 mu M (4a) and 0.8 mu M (4b) (S/N=3), respectively. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2015.06.055
• 作为产物：
  描述：

  isoquinolinium dicyanomethylide 、 丙炔酸甲酯 以 乙腈 为溶剂， 以94%的产率得到Methyl-3-cyanpyrrolo<2.1-α>isoquinolin-1-carboxylat
  参考文献：
  名称：

  Matsumoto, Kiyoshi; Ikemi, Yukio; Konishi, Hideyuki, Journal of Heterocyclic Chemistry, 1988, vol. 25, # 2, p. 689 - 692

  摘要：

  DOI：

文献信息

• Two fluorescence turn-on chemosensors based on pyrrolo[2,1-a]isoquinoline for detection of Ag+ in aqueous solution
  作者：Yuliang Jiang、Weiwei Kong、Yongmiao Shen、Bingxiang Wang

  DOI：10.1016/j.tet.2015.06.055

  日期：2015.8

  In this study, two water-soluble fluorescent probes based on pyrrolo[2,1-a]isoquinoline derivatives (4a and 4b) were synthesized and characterized by IR, H-1 NMR, C-13 NMR, MS spectra and elemental analysis for the first time. The obtained compounds (4a and 4b) showed fluorescent 'turn-on' phenomenon to Ag+ with limits of detection (LOD) of 0.6 mu M (4a) and 0.8 mu M (4b) (S/N=3), respectively. (C) 2015 Elsevier Ltd. All rights reserved.
• Matsumoto, Kiyoshi; Ikemi, Yukio; Konishi, Hideyuki, Journal of Heterocyclic Chemistry, 1988, vol. 25, # 2, p. 689 - 692
  作者：Matsumoto, Kiyoshi、Ikemi, Yukio、Konishi, Hideyuki、Shi, Xiao-lan、Uchida, Takane、Aoyama, Kinuyo

  DOI：——

  日期：——