2,4-dioctyl pyridinedicarboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 2,4-dioctyl pyridinedicarboxylate
• 英文别名: Dioctyl pyridine-2,4-dicarboxylate；dioctyl pyridine-2,4-dicarboxylate
• 化学式: C₂₃H₃₇NO₄
• 分子量: 391.551
• InChiKey: HFFVBEAUAUINBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.7
• 重原子数：
  28
• 可旋转键数：
  18
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  65.5
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  辛醇 、 2,4-二乙基吡啶二羧酸 在 Mucor miehei lipase 4 A molecular sieve 作用下， 以 异丙醚 为溶剂， 反应 240.0h， 生成 2-ethyl-4-octyl pyridinedicarboxylate 、 2-octyl-4-ethyl pyridinedicarboxylate 、 2,4-dioctyl pyridinedicarboxylate
  参考文献：
  名称：

  Mucor miehei lipase catalyzed transesterifications on aromatic and heteroaromatic substrates. A general survey

  摘要：

  An investigation on Mucor miehei lipase-catalyzed transesterifications of 16 aromatic and heteroaromatic esters in organic solvents is described. The points studied were the activity and regioselectivity of the enzyme-catalyzed reaction of either one or two ester groups situated in different positions on several heterocyclic systems with an aliphatic alcohol. The reactions took place in moderate to good yields and, in some cases, regioselectively.

  DOI：

  10.1016/s0040-4020(01)81352-1

文献信息

• Mucor miehei lipase catalyzed transesterifications on aromatic and heteroaromatic substrates. A general survey
  作者：María Gema Martín-Muñoz、Marta Fierros、María Isabel Rodriguez-Franco、Santiago Conde

  DOI：10.1016/s0040-4020(01)81352-1

  日期：——

  An investigation on Mucor miehei lipase-catalyzed transesterifications of 16 aromatic and heteroaromatic esters in organic solvents is described. The points studied were the activity and regioselectivity of the enzyme-catalyzed reaction of either one or two ester groups situated in different positions on several heterocyclic systems with an aliphatic alcohol. The reactions took place in moderate to good yields and, in some cases, regioselectively.