扁桃酸
共晶
化学
手性拆分
对映体
过程(计算)
分辨率(逻辑)
组合化学
立体化学
有机化学
氢键
分子
计算机科学
操作系统
人工智能
作者
Xavier Buol,Camila Caro Garrido,Koen Robeyns,Nikolay Tumanov,Laurent Collard,Johan Wouters,Tom Leyssens
标识
DOI:10.1021/acs.cgd.0c01236
摘要
In this paper, we identified a cocrystal conglomerate of mandelic acid using a drug compound as a coformer. We then developed a chiral resolution process based on preferential cocrystallization. Several versions of such a process were explored and optimized, leading to a successful resolution of mandelic acid, evidencing the efficiency of our system. Excellent enantiopurity (98–99%) was obtained with a process that can run for multiple cycles.
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