7,7-Dimethylspiro[2.5]octane-4,6,8-trione | 1042140-81-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 7,7-Dimethylspiro[2.5]octane-4,6,8-trione
• 英文别名: 7,7-dimethylspiro[2.5]octane-4,6,8-trione
• CAS: 1042140-81-7
• 化学式: C₁₀H₁₂O₃
• 分子量: 180.203
• InChiKey: YPMFWVCJBNOCLR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  51.2
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  在 sodium methylate 作用下， 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 2.0h， 以87%的产率得到7,7-Dimethylspiro[2.5]octane-4,6,8-trione
  参考文献：
  名称：

  Design and synthesis of novel spirocyclopropyl cyclohexane-1,3-diones and -1,3,5-triones for their incorporation into potent HPPD inhibitors

  摘要：

  We report the design and the efficient synthesis of novel spirocyclopropyl cyclohexane-1,3-dione and -1,3,5-trione units to be incorporated into potent HPPD inhibitors. New routes involving original combinations of synthetic equivalents of alpha-cyclopropyl ketone-alpha-anion and alpha-cyclopropyl ester-beta-cation are described. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.03.047

文献信息

• Design and synthesis of novel spirocyclopropyl cyclohexane-1,3-diones and -1,3,5-triones for their incorporation into potent HPPD inhibitors
  作者：Renaud Beaudegnies、Alain De Mesmaeker、Aurélie Mallinger、Myriam Baalouch、André Goetz

  DOI：10.1016/j.tetlet.2010.03.047

  日期：2010.5

  We report the design and the efficient synthesis of novel spirocyclopropyl cyclohexane-1,3-dione and -1,3,5-trione units to be incorporated into potent HPPD inhibitors. New routes involving original combinations of synthetic equivalents of alpha-cyclopropyl ketone-alpha-anion and alpha-cyclopropyl ester-beta-cation are described. (C) 2010 Elsevier Ltd. All rights reserved.