acetic acid (S)-1-(dimethylphenylsilyl)prop-2-enyl ester | 1233923-69-7

• 分子结构分类: 有机化合物 - 有机金属化合物 - 有机类金属化合物
• 英文名称: acetic acid (S)-1-(dimethylphenylsilyl)prop-2-enyl ester
• CAS: 1233923-69-7
• 化学式: C₁₃H₁₈O₂Si
• 分子量: 234.37
• InChiKey: DKHOQSPCFUJQBJ-ZDUSSCGKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.26
• 重原子数：
  16.0
• 可旋转键数：
  4.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  acetic acid (S)-1-(dimethylphenylsilyl)prop-2-enyl ester 在 二异丁基氢化铝 作用下， 以 正己烷 为溶剂， 反应 2.5h， 以81%的产率得到(S)-1-(dimethylphenylsilyl)-2-propen-1-ol
  参考文献：
  名称：

  Enzymatic kinetic resolution of α-hydroxysilanes

  摘要：

  The enzymatic kinetic resolution of alpha-hydroxysilanes where the silicon bears a variety of substituents has been explored. Reactions were performed on various alpha-hydroxysilanes with several commercially available enzymes, solvents, acetylation reagents, and temperatures. The resulting optically active alpha-hydroxysilanes and their corresponding acetates were obtained in varying yields and ees. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2010.02.030
• 作为产物：
  描述：

  1-(dimethylphenylsilyl)prop-2-en-1-ol 、 乙酸乙烯酯 在 Novozym 435 作用下， 以 正戊烷 为溶剂， 反应 49.0h， 以37%的产率得到acetic acid (S)-1-(dimethylphenylsilyl)prop-2-enyl ester
  参考文献：
  名称：

  Enzymatic kinetic resolution of α-hydroxysilanes

  摘要：

  The enzymatic kinetic resolution of alpha-hydroxysilanes where the silicon bears a variety of substituents has been explored. Reactions were performed on various alpha-hydroxysilanes with several commercially available enzymes, solvents, acetylation reagents, and temperatures. The resulting optically active alpha-hydroxysilanes and their corresponding acetates were obtained in varying yields and ees. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2010.02.030