Dimethyl 2-methylidene-3-(1-nitrooctyl)butanedioate | 1218793-41-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: Dimethyl 2-methylidene-3-(1-nitrooctyl)butanedioate
• 英文别名: dimethyl 2-methylidene-3-(1-nitrooctyl)butanedioate
• CAS: 1218793-41-9
• 化学式: C₁₅H₂₅NO₆
• 分子量: 315.367
• InChiKey: LRMKLMQDIQWUJH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  22
• 可旋转键数：
  12
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  98.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  1-硝基辛烷 、 dimethyl (Z)-2-(bromomethyl)fumarate 在 十六烷基三甲基氢氧化铵 作用下， 以 水 为溶剂， 反应 7.0h， 以70%的产率得到Dimethyl 2-methylidene-3-(1-nitrooctyl)butanedioate
  参考文献：
  名称：

  Chemoselective SN2′ reaction of nitroalkanes to dialkyl 2-(bromomethyl)fumarates under cetyltrimethylammonium hydroxide (CTAOH) catalysis

  摘要：

  The chemoselective S(N)2' reaction of a variety of primary nitroalkanes to dialkyl 2-(bromomethyl)fumarates can be efficiently performed under cetyltrimethylammonium hydroxide (CTAOH) catalysis. The alpha, beta-unsaturated esters were obtained in satisfactory to good yields with the complete retention of the nitro group. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.12.122

文献信息

• Chemoselective SN2′ reaction of nitroalkanes to dialkyl 2-(bromomethyl)fumarates under cetyltrimethylammonium hydroxide (CTAOH) catalysis
  作者：Roberto Ballini、Serena Gabrielli、Alessandro Palmieri

  DOI：10.1016/j.tetlet.2009.12.122

  日期：2010.2

  The chemoselective S(N)2' reaction of a variety of primary nitroalkanes to dialkyl 2-(bromomethyl)fumarates can be efficiently performed under cetyltrimethylammonium hydroxide (CTAOH) catalysis. The alpha, beta-unsaturated esters were obtained in satisfactory to good yields with the complete retention of the nitro group. (C) 2009 Elsevier Ltd. All rights reserved.