A computational triage approach to the synthesis of novel difluorocyclopentenes and fluorinated cycloheptadienes using thermal rearrangements
Author:
Affiliation:
1. WestCHEM Department of Pure and Applied Chemistry
2. University of Strathclyde
3. Glasgow
4. UK
5. Refractory Respiratory Inflammation DPU
6. GlaxoSmithKline Medicines Research Centre
7. Stevenage
Abstract
Electronic structure calculations have been used for the effective triage of substituent effects on difluorinated vinylcyclopropane precursors and their ability to undergo vinyl cyclopropane rearrangements (VCPR).
Funder
University of Strathclyde
Publisher
Royal Society of Chemistry (RSC)
Subject
General Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2016/SC/C6SC01289B
Reference69 articles.
1. S. M. Bachrach , Computational Organic Chemistry, John Wiley & Sons, Inc., Hoboken, New Jersey, 2nd edn, 2014
2. C. J. Cramer , Essentials of Computational Chemistry: Theories and Models, John Wiley & Sons, Ltd., Chichester, West Sussex, 2nd edn, 2004
3. Control and Design of Mutual Orthogonality in Bioorthogonal Cycloadditions
4. Mechanism of Alkoxy Groups Substitution by Grignard Reagents on Aromatic Rings and Experimental Verification of Theoretical Predictions of Anomalous Reactions
5. Computational prediction of small-molecule catalysts
Cited by 14 articles. 订阅此论文施引文献 订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. Collaborative GSK–University of Strathclyde doctoral research and training programmes: Transforming approaches to industry–academia engagement;Drug Discovery Today;2024-09
2. Vinylcyclopropane-Cyclopentene (VCP-CP) Rearrangement Enabled by Pyridine-Assisted Boronyl Radical Catalysis;Organic Letters;2024-06-14
3. Palladium Hydride-Enabled Hydroalkenylation of Strained Molecules;Journal of the American Chemical Society;2022-10-31
4. Switchable light vs. acid-induced transformations of complex framework compounds at room temperature;Green Chemistry;2022
5. Synthesis of an allylic gem-difluoromethylene building block via radical-mediated difluorocyclopropane ring opening;Tetrahedron Letters;2021-09
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线,采集、加工和组织学术论文而形成的新型学术文献查询和分析系统,可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容,当前同舟云学术共收录了国内外主流学术期刊6万余种,收集的期刊论文及会议论文总量共计约1.5亿篇,并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询!咨询电话:010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3