2-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-butan-1-one | 145192-05-8

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: 2-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-butan-1-one
• 英文别名: 2-(4-Chlorophenyl)-1-(4-methoxyphenyl)butan-1-one
• CAS: 145192-05-8
• 化学式: C₁₇H₁₇ClO₂
• 分子量: 288.774
• InChiKey: KKWXYJMSIHHRRY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  20
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-butan-1-one 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 、 乙腈 为溶剂， 反应 4.0h， 生成 1-[2-(4-Chlorophenyl)-1-(4-methoxyphenyl)butyl]imidazole
  参考文献：
  名称：

  Antifungal agents. 1. Synthesis and antifungal activities of estrogen-like imidazole and triazole derivatives

  摘要：

  The synthesis of some 2-aryl-1-(4-methoxyphenyl)-1-(1H-imidazol-1-yl)ethane derivatives and related IH-1,2,4- and 1H-1,3,4-triazoles is described. The molecular structure of new derivatives has been established by IH NMR spectra and X-ray crystallographic analysis. When tested in solid agar cultures the azole derivatives showed from moderate to potent in vitro antifungal activity against Candida albicans and Candida spp.

  DOI：

  10.1016/0223-5234(92)90183-2
• 作为产物：
  描述：

  对氯苯乙酰氯 在 三氯化铝 、 sodium hydride 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 2.0h， 生成 2-(4-Chloro-phenyl)-1-(4-methoxy-phenyl)-butan-1-one
  参考文献：
  名称：

  Antifungal agents. 1. Synthesis and antifungal activities of estrogen-like imidazole and triazole derivatives

  摘要：

  The synthesis of some 2-aryl-1-(4-methoxyphenyl)-1-(1H-imidazol-1-yl)ethane derivatives and related IH-1,2,4- and 1H-1,3,4-triazoles is described. The molecular structure of new derivatives has been established by IH NMR spectra and X-ray crystallographic analysis. When tested in solid agar cultures the azole derivatives showed from moderate to potent in vitro antifungal activity against Candida albicans and Candida spp.

  DOI：

  10.1016/0223-5234(92)90183-2

文献信息

• Antifungal agents. 1. Synthesis and antifungal activities of estrogen-like imidazole and triazole derivatives
  作者：S Massa、R Di Santo、A Retico、M Artico、N Simonetti、G Fabrizi、D Lamba

  DOI：10.1016/0223-5234(92)90183-2

  日期：1992.8

  The synthesis of some 2-aryl-1-(4-methoxyphenyl)-1-(1H-imidazol-1-yl)ethane derivatives and related IH-1,2,4- and 1H-1,3,4-triazoles is described. The molecular structure of new derivatives has been established by IH NMR spectra and X-ray crystallographic analysis. When tested in solid agar cultures the azole derivatives showed from moderate to potent in vitro antifungal activity against Candida albicans and Candida spp.