1-(phenylthio)ethyl butanoate | 188707-10-0

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 1-(phenylthio)ethyl butanoate
• 英文别名: 1-(Phenylsulfanyl)ethyl butanoate；1-phenylsulfanylethyl butanoate
• CAS: 188707-10-0
• 化学式: C₁₂H₁₆O₂S
• 分子量: 224.324
• InChiKey: IGGNAAWBMGZKLR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  正丁酸乙烯酯 、 苯硫酚 在 pseudomonas lipase 作用下， 以 甲苯 为溶剂， 反应 72.0h， 以57%的产率得到1-(phenylthio)ethyl butanoate
  参考文献：
  名称：

  Synthesis of α-Arylthioalkyl Esters: The Addition Reactions of Vinyl Esters with Arylthiols Catalyzed by Lipase

  摘要：

  Abstractα‐Arylthioalkyl esters can be prepared by the addition reactions of vinyl esters with arylthiols in the presence of Pseudomonas lipase (PSL) as catalyst. In the toluene, the reaction mixtures were stirred at 60 °C for three days, the chemical yields up to 85% were obtained.

  DOI：

  10.1002/jccs.199700012

文献信息

• Synthesis of α-Arylthioalkyl Esters: The Addition Reactions of Vinyl Esters with Arylthiols Catalyzed by Lipase
  作者：Ren-Shen Lee

  DOI：10.1002/jccs.199700012

  日期：1997.2

  Abstractα‐Arylthioalkyl esters can be prepared by the addition reactions of vinyl esters with arylthiols in the presence of Pseudomonas lipase (PSL) as catalyst. In the toluene, the reaction mixtures were stirred at 60 °C for three days, the chemical yields up to 85% were obtained.