3-phenyl-1,5-dimethyl-3-azabicyclo-<3.1.0>hexane-2,4-dione | 884-79-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 3-phenyl-1,5-dimethyl-3-azabicyclo-<3.1.0>hexane-2,4-dione
• 英文别名: 1,5-dimethyl-3-phenyl-3-aza-bicyclo[3.1.0]hexane-2,4-dione；1,5-Dimethyl-3-phenyl-3-aza-bicyclo[3.1.0]hexan-2,4-dion；1,5-Dimethyl-3-phenyl-3-azabicyclo[3.1.0]hexane-2,4-dione
• CAS: 884-79-7
• 化学式: C₁₃H₁₃NO₂
• 分子量: 215.252
• InChiKey: ZTDBCQZLESFUSU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  37.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1,2-dimethyl-2-phenylcarbamoyl-cyclopropanecarboxylic acid 生成 3-phenyl-1,5-dimethyl-3-azabicyclo-<3.1.0>hexane-2,4-dione
  参考文献：
  名称：

  Paolini, Gazzetta Chimica Italiana, 1900, vol. 30, p. II 505

  摘要：

  DOI：

文献信息

• v. Auwers; Ungemach, Justus Liebigs Annalen der Chemie, 1934, vol. 511, p. 152,161
  作者：v. Auwers、Ungemach

  DOI：——

  日期：——
• Fungicides and photochemistry photodegradation of the dicarboximide fungicide procymidone
  作者：W. Schwack、B. Bourgeois、F. Walker

  DOI：10.1016/0045-6535(95)80004-5

  日期：1995.11

  The photoreactivity of the dicarboximide fungicide procymidone ((1) under bar) (3-(3,5-dichlorophenyl)-1,5-dimethyl-3-azabicyclo[3.1.0]hexane-2,4-dione) on plant surfaces was studied by irradiation experiments in different organic solvents simulating the plant cuticle environment. Photodegradation (lambda > 280 nm) increased in the order isopropanol, cyclohexane, cyclohexene. In the presence of isopropanol or cyclohexane, mainly photodehalogenation reactions were observed, which, to a minor extent, competed with substitutions by solvent molecules. In the presence of cyclohexene, however, substitution of a phenyl-Cl by the the solvent was strongly preferred and the monodehalogenated procymidone was only found in low percentages.