GSTDTAP  > 地球科学
DOI10.1126/science.aat0650
Reconfigurable system for automated optimization of diverse chemical reactions
Bedard, Anne-Catherine1; Adamo, Andrea2; Aroh, Kosi C.2; Russell, M. Grace1; Bedermann, Aaron A.1; Torosian, Jeremy2; Yue, Brian2; Jensen, Klavs F.2; Jamison, Timothy F.1
2018-09-21
发表期刊SCIENCE
ISSN0036-8075
EISSN1095-9203
出版年2018
卷号361期号:6408页码:1220-+
文章类型Article
语种英语
国家USA
英文摘要

Chemical synthesis generally requires labor-intensive, sometimes tedious trial-and-error optimization of reaction conditions. Here, we describe a plug-and-play, continuous-flow chemical synthesis system that mitigates this challenge with an integrated combination of hardware, software, and analytics. The system software controls the user-selected reagents and unit operations (reactors and separators), processes reaction analytics (high-performance liquid chromatography, mass spectrometry, vibrational spectroscopy), and conducts automated optimizations. The capabilities of this system are demonstrated in high-yielding implementations of C-C and C-N cross-coupling, olefination, reductive amination, nucleophilic aromatic substitution (SNAr), photoredox catalysis, and a multistep sequence. The graphical user interface enables users to initiate optimizations, monitor progress remotely, and analyze results. Subsequent users of an optimized procedure need only download an electronic file, comparable to a smartphone application, to implement the protocol on their own apparatus.


领域地球科学 ; 气候变化 ; 资源环境
收录类别SCI-E
WOS记录号WOS:000445152500034
WOS关键词CONTINUOUS-FLOW ; ORGANIC-SYNTHESIS ; VISIBLE-LIGHT ; MICROFLUIDIC SYSTEM ; SELF-OPTIMIZATION ; PHOTOREDOX ; PLATFORM ; MOLECULES ; CHEMISTRY ; CATALYSIS
WOS类目Multidisciplinary Sciences
WOS研究方向Science & Technology - Other Topics
引用统计
文献类型期刊论文
条目标识符http://119.78.100.173/C666/handle/2XK7JSWQ/199629
专题地球科学
资源环境科学
气候变化
作者单位1.MIT, Dept Chem, Cambridge, MA 02139 USA;
2.MIT, Dept Chem Engn, Cambridge, MA 02139 USA
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Bedard, Anne-Catherine,Adamo, Andrea,Aroh, Kosi C.,et al. Reconfigurable system for automated optimization of diverse chemical reactions[J]. SCIENCE,2018,361(6408):1220-+.
APA Bedard, Anne-Catherine.,Adamo, Andrea.,Aroh, Kosi C..,Russell, M. Grace.,Bedermann, Aaron A..,...&Jamison, Timothy F..(2018).Reconfigurable system for automated optimization of diverse chemical reactions.SCIENCE,361(6408),1220-+.
MLA Bedard, Anne-Catherine,et al."Reconfigurable system for automated optimization of diverse chemical reactions".SCIENCE 361.6408(2018):1220-+.
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