allyl (2R)-(4-methoxybenzyloxy)-{(4R)-5-oxo-2,2-bis-trifluoromethyl-[1,3]dioxolan-4-yl}-acetate | 1238620-46-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: allyl (2R)-(4-methoxybenzyloxy)-{(4R)-5-oxo-2,2-bis-trifluoromethyl-[1,3]dioxolan-4-yl}-acetate
• 英文别名: prop-2-enyl (2R)-2-[(4-methoxyphenyl)methoxy]-2-[(4R)-5-oxo-2,2-bis(trifluoromethyl)-1,3-dioxolan-4-yl]acetate
• CAS: 1238620-46-6
• 化学式: C₁₈H₁₆F₆O₇
• 分子量: 458.311
• InChiKey: SNQBFAIPVNUAQT-CHWSQXEVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  31
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  80.3
• 氢给体数：
  0
• 氢受体数：
  13

反应信息

• 作为反应物：
  描述：

  allyl (2R)-(4-methoxybenzyloxy)-{(4R)-5-oxo-2,2-bis-trifluoromethyl-[1,3]dioxolan-4-yl}-acetate 在 水 作用下， 以 异丙醇 为溶剂， 反应 15.0h， 以97%的产率得到(2R,3R)-2-O-(4-methoxybenzyl)-1-allyl tartrate
  参考文献：
  名称：

  Total Regioselective Control of Tartaric Acid

  摘要：

  An efficient strategy to synthesize tartaric acid building blocks for totally regioselective transformations or derivatizations was disclosed. Starting from L-tartaric acid or L-dimethyl tartrate, respectively, we obtained type I and II building blocks with orthogonal sets of protecing groups (4-8 steps, 38-56% overall yield).

  DOI：

  10.1021/jo101001s
• 作为产物：
  描述：

  、 烯丙醇 以 乙醚 为溶剂， 以0.6 g的产率得到allyl (2R)-(4-methoxybenzyloxy)-{(4R)-5-oxo-2,2-bis-trifluoromethyl-[1,3]dioxolan-4-yl}-acetate
  参考文献：
  名称：

  Total Regioselective Control of Tartaric Acid

  摘要：

  An efficient strategy to synthesize tartaric acid building blocks for totally regioselective transformations or derivatizations was disclosed. Starting from L-tartaric acid or L-dimethyl tartrate, respectively, we obtained type I and II building blocks with orthogonal sets of protecing groups (4-8 steps, 38-56% overall yield).

  DOI：

  10.1021/jo101001s

文献信息

• Total Regioselective Control of Tartaric Acid
  作者：Jan Spengler、Ana I. Fernández-Llamazares、Javier Ruiz-Rodríguez、Klaus Burger、Fernando Albericio

  DOI：10.1021/jo101001s

  日期：2010.8.20

  An efficient strategy to synthesize tartaric acid building blocks for totally regioselective transformations or derivatizations was disclosed. Starting from L-tartaric acid or L-dimethyl tartrate, respectively, we obtained type I and II building blocks with orthogonal sets of protecing groups (4-8 steps, 38-56% overall yield).