IF 3.1 3区 化学 Q2 CHEMISTRY, APPLIED
Vittorio Farina
{"title":"On Scalability, Synthetic Efficiency, and Convergency","authors":"Vittorio Farina","doi":"10.1021/acs.oprd.5c00030","DOIUrl":null,"url":null,"abstract":"Terms like <i>scalability</i>, <i>synthetic efficiency</i>, and <i>convergency</i> are often used by development chemists to qualify the merits of their processes. However, these are often qualitative designations, devoid of any quantitative assessment. We propose some guidelines to support the judicious use of these terms. In particular, we would like to bring to the attention of process chemists the work of J. B. Hendrickson, who─almost 50 years ago─first proposed a meaningful quantitative evaluation of a synthetic plan and defined <i>consistency</i> and <i>convergency</i> in a quantitative way. After a brief analysis of the term <i>scalability</i>, this perspective presents a simplified version of Hendrickson’s ideas and extends it to multicomponent reactions. The metrics proposed herein are very easy to use and should allow chemists to verify the efficiency of their synthetic plan by calculating a <i>consistency index</i> and a <i>convergency index</i> which could complement qualitative descriptors like “efficient process” or “highly convergent synthesis”.","PeriodicalId":55,"journal":{"name":"Organic Process Research & Development","volume":"33 1","pages":""},"PeriodicalIF":3.1000,"publicationDate":"2025-03-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Organic Process Research & Development","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.1021/acs.oprd.5c00030","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, APPLIED","Score":null,"Total":0}
引用次数: 0

摘要

开发化学家经常使用可扩展性、合成效率和收敛性等术语来评价其工艺的优劣。然而,这些术语通常都是定性的,缺乏任何定量评估。我们提出了一些指导原则,以支持合理使用这些术语。特别是,我们希望提请工艺化学家注意 J. B. Hendrickson 的工作,他在近 50 年前首次提出了对合成计划进行有意义的定量评估,并以定量的方式定义了一致性和收敛性。在简要分析了可扩展性这一术语之后,本章提出了亨德里克森思想的简化版本,并将其扩展到多组分反应。本文提出的指标非常容易使用,化学家可以通过计算一致性指数和收敛性指数来验证其合成计划的效率,从而补充 "高效工艺 "或 "高收敛性合成 "等定性描述。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

On Scalability, Synthetic Efficiency, and Convergency

On Scalability, Synthetic Efficiency, and Convergency
Terms like scalability, synthetic efficiency, and convergency are often used by development chemists to qualify the merits of their processes. However, these are often qualitative designations, devoid of any quantitative assessment. We propose some guidelines to support the judicious use of these terms. In particular, we would like to bring to the attention of process chemists the work of J. B. Hendrickson, who─almost 50 years ago─first proposed a meaningful quantitative evaluation of a synthetic plan and defined consistency and convergency in a quantitative way. After a brief analysis of the term scalability, this perspective presents a simplified version of Hendrickson’s ideas and extends it to multicomponent reactions. The metrics proposed herein are very easy to use and should allow chemists to verify the efficiency of their synthetic plan by calculating a consistency index and a convergency index which could complement qualitative descriptors like “efficient process” or “highly convergent synthesis”.
求助全文
通过发布文献求助,成功后即可免费获取论文全文。 去求助
来源期刊
CiteScore
6.90
自引率
14.70%
发文量
251
审稿时长
2 months
期刊介绍: The journal Organic Process Research & Development serves as a communication tool between industrial chemists and chemists working in universities and research institutes. As such, it reports original work from the broad field of industrial process chemistry but also presents academic results that are relevant, or potentially relevant, to industrial applications. Process chemistry is the science that enables the safe, environmentally benign and ultimately economical manufacturing of organic compounds that are required in larger amounts to help address the needs of society. Consequently, the Journal encompasses every aspect of organic chemistry, including all aspects of catalysis, synthetic methodology development and synthetic strategy exploration, but also includes aspects from analytical and solid-state chemistry and chemical engineering, such as work-up tools,process safety, or flow-chemistry. The goal of development and optimization of chemical reactions and processes is their transfer to a larger scale; original work describing such studies and the actual implementation on scale is highly relevant to the journal. However, studies on new developments from either industry, research institutes or academia that have not yet been demonstrated on scale, but where an industrial utility can be expected and where the study has addressed important prerequisites for a scale-up and has given confidence into the reliability and practicality of the chemistry, also serve the mission of OPR&D as a communication tool between the different contributors to the field.
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
copy
已复制链接
快去分享给好友吧!
我知道了
右上角分享
点击右上角分享
0
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信