(6-hydrazino-pyridazin-3-yl)-(4-methoxyphenyl)-acetonitrile | 1159497-71-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: (6-hydrazino-pyridazin-3-yl)-(4-methoxyphenyl)-acetonitrile
• 英文别名: 2-(6-Hydrazinylpyridazin-3-yl)-2-(4-methoxyphenyl)acetonitrile
• CAS: 1159497-71-8
• 化学式: C₁₃H₁₃N₅O
• 分子量: 255.279
• InChiKey: XIUPWTPYLGNWAY-UHFFFAOYSA-N

物化性质

• 沸点：
  463.7±55.0 °C(predicted)
• 密度：
  1.28±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  96.8
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  5-硝基噻吩-2-甲醛 、 (6-hydrazino-pyridazin-3-yl)-(4-methoxyphenyl)-acetonitrile 以 乙醇 为溶剂， 反应 1.0h， 以62%的产率得到2-(4-methoxyphenyl)-2-{6-{2-[(5-nitrothiophen-2-yl)methylene]hydrazinyl}pyridazin-3-yl}acetonitrile
  参考文献：
  名称：

  Synthesis, Fungicidal and Antibacterial Activity of New Pyridazine Derivatives

  摘要：

  Compounds 1 - 3 were obtained in the reaction of 3,6-dichloropyridazines with phenylacetonitriles in the biphasic system - DMSO / 50% NaOH. The chlorine atom was replaced with cycloalkylamino (4 - 13) and hydrazinyl (23, 24) moiety. These last compounds were condensed with aldehydes (25 - 34). Pyridazynylphenylacetonitriles were converted into amides 14 - 18 and thioamides 19 - 22. In compounds 2, 3 the chlorine atom was replaced with thiophenyl (37, 38) and in compound 1 with thioethyl and thiophenyl (35, 36) functional groups. In the reactions of compounds 1, 2 with ammonium polysulfide thioamides with thiol group (39, 40) and chlorine atom (41, 42) were obtained. Compounds 1 - 17, 19 43 were screened for antibacterial and fungicidal activities.

  DOI：

  10.3987/com-08-11577
• 作为产物：
  描述：

  2-(6-chloropyridazin-3-yl)-2-(4-methoxyphenyl)acetonitrile 在 一水合肼 作用下， 以 乙醇 为溶剂， 反应 3.0h， 以50%的产率得到(6-hydrazino-pyridazin-3-yl)-(4-methoxyphenyl)-acetonitrile
  参考文献：
  名称：

  Synthesis, Fungicidal and Antibacterial Activity of New Pyridazine Derivatives

  摘要：

  Compounds 1 - 3 were obtained in the reaction of 3,6-dichloropyridazines with phenylacetonitriles in the biphasic system - DMSO / 50% NaOH. The chlorine atom was replaced with cycloalkylamino (4 - 13) and hydrazinyl (23, 24) moiety. These last compounds were condensed with aldehydes (25 - 34). Pyridazynylphenylacetonitriles were converted into amides 14 - 18 and thioamides 19 - 22. In compounds 2, 3 the chlorine atom was replaced with thiophenyl (37, 38) and in compound 1 with thioethyl and thiophenyl (35, 36) functional groups. In the reactions of compounds 1, 2 with ammonium polysulfide thioamides with thiol group (39, 40) and chlorine atom (41, 42) were obtained. Compounds 1 - 17, 19 43 were screened for antibacterial and fungicidal activities.

  DOI：

  10.3987/com-08-11577

文献信息

• Synthesis, Fungicidal and Antibacterial Activity of New Pyridazine Derivatives
  作者：Henryk Foks、Krystyna Wisterowicz、Agnieszka Miszke、Kamil Brożewicz、Katarzyna Wiśniewska、Maria Dąbrowska-Szponar

  DOI：10.3987/com-08-11577

  日期：——

  Compounds 1 - 3 were obtained in the reaction of 3,6-dichloropyridazines with phenylacetonitriles in the biphasic system - DMSO / 50% NaOH. The chlorine atom was replaced with cycloalkylamino (4 - 13) and hydrazinyl (23, 24) moiety. These last compounds were condensed with aldehydes (25 - 34). Pyridazynylphenylacetonitriles were converted into amides 14 - 18 and thioamides 19 - 22. In compounds 2, 3 the chlorine atom was replaced with thiophenyl (37, 38) and in compound 1 with thioethyl and thiophenyl (35, 36) functional groups. In the reactions of compounds 1, 2 with ammonium polysulfide thioamides with thiol group (39, 40) and chlorine atom (41, 42) were obtained. Compounds 1 - 17, 19 43 were screened for antibacterial and fungicidal activities.