(S)-2-amino-2-(3-(trifluoromethyl)phenyl)acetic acid | 1228568-48-6

• 物质功能分类: 有机原料 - 羧酸类化合物及衍生物
• 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: (S)-2-amino-2-(3-(trifluoromethyl)phenyl)acetic acid
• 英文别名: (2S)-2-azaniumyl-2-[3-(trifluoromethyl)phenyl]acetate
• CAS: 1228568-48-6
• 化学式: C₉H₈F₃NO₂
• 分子量: 219.163
• InChiKey: SRHNOGZIXICHOU-ZETCQYMHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.8
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  63.3
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  3-三氟甲基-DL-苯基甘氨酸 在 lipase AS 'Amano' 、 三乙胺 作用下， 以 水 、 N,N-二甲基甲酰胺 为溶剂， 反应 24.0h， 生成 、 (S)-2-amino-2-(3-(trifluoromethyl)phenyl)acetic acid
  参考文献：
  名称：

  Efficient kinetic resolution of amino acids catalyzed by lipase AS ‘Amano’ via cleavage of an amide bond

  摘要：

  Herein the efficient kinetic resolution of non-natural alpha-amino acids catalyzed by lipase AS 'Amano' via cleaving the amide bond is reported. The starting materials were the corresponding amino acid amides and the amino acids were generated with ees of up to 99% with E values of > 600. These results indicated that the lipase AS 'Amano' could be a powerful amide hydrolase for the kinetic resolution of amino acid starting from the corresponding amino acid amides. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2012.08.017

文献信息

• Efficient kinetic resolution of amino acids catalyzed by lipase AS ‘Amano’ via cleavage of an amide bond
  作者：Bo Wang、Yanfeng Liu、Dela Zhang、Yuhong Feng、Jiacheng Li

  DOI：10.1016/j.tetasy.2012.08.017

  日期：2012.10

  Herein the efficient kinetic resolution of non-natural alpha-amino acids catalyzed by lipase AS 'Amano' via cleaving the amide bond is reported. The starting materials were the corresponding amino acid amides and the amino acids were generated with ees of up to 99% with E values of > 600. These results indicated that the lipase AS 'Amano' could be a powerful amide hydrolase for the kinetic resolution of amino acid starting from the corresponding amino acid amides. (C) 2012 Elsevier Ltd. All rights reserved.