(R)-N-(6-hydroxy-6-methylheptan-2-yl)-3-methoxypropanamide | 1322805-07-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (R)-N-(6-hydroxy-6-methylheptan-2-yl)-3-methoxypropanamide
• 英文别名: N-[(2R)-6-hydroxy-6-methylheptan-2-yl]-3-methoxypropanamide
• CAS: 1322805-07-1
• 化学式: C₁₂H₂₅NO₃
• 分子量: 231.335
• InChiKey: PTEHFAXWLSXWHW-SNVBAGLBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  16
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-甲氧基丙酸甲酯 、 5-amino-2-methylheptan-2-ol 在 supported Candida antartica lipase B 作用下， 以 甲基叔丁基醚 为溶剂， 反应 6.0h， 生成 (R)-5-amino-2-methylheptan-2-ol 、 (S)-5-amino-2-methylheptan-2-ol 、 (R)-N-(6-hydroxy-6-methylheptan-2-yl)-3-methoxypropanamide
  参考文献：
  名称：

  Chemoenzymatic Dynamic Kinetic Resolution of Primary Amines Catalyzed by CAL-B at 38–40 °C

  摘要：

  The (R)-selective chemoenzymatic dynamic kinetic resolution of primary amines was performed at 38-40 degrees C in MTBE, in good to high yields and with high enantiomeric excesses. These reactions associating CAL-B to octanethiol as radical racemizing agent were carried out in the presence of methyl beta-methoxy propanoate as acyl donor, under photochemical irradiation at 350 nm in glassware.

  DOI：

  10.1021/jo201256w

文献信息

• Chemoenzymatic Dynamic Kinetic Resolution of Primary Amines Catalyzed by CAL-B at 38–40 °C
  作者：Florent Poulhès、Nicolas Vanthuyne、Michèle P. Bertrand、Stéphane Gastaldi、Gérard Gil

  DOI：10.1021/jo201256w

  日期：2011.9.2

  The (R)-selective chemoenzymatic dynamic kinetic resolution of primary amines was performed at 38-40 degrees C in MTBE, in good to high yields and with high enantiomeric excesses. These reactions associating CAL-B to octanethiol as radical racemizing agent were carried out in the presence of methyl beta-methoxy propanoate as acyl donor, under photochemical irradiation at 350 nm in glassware.