主要文件

901735

1-Benzyl 2-methyl (2S,4R)-4-((4-bromoisoindoline-2-carbonyl)oxy)pyrrolidine-1,2-dicarboxylate

Name: 1-Benzyl 2-methyl (2<I>S</I>,4<I>R</I>)-4-((4-bromoisoindoline-2-carbonyl)oxy)pyrrolidine-1,2-dicarboxylate
Brand: ALDRICH

别名:

Aryl halide chemistry informer library compound X8

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关于此项目

经验公式（希尔记法）:

C₂₃H₂₃BrN₂O₆

化学文摘社编号:

1269195-05-2

分子量:

503.34

MDL number:

MFCD00149998

NACRES:

NA.22

UNSPSC Code:

12352101

Form:

powder

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属性

form

powder

mp

99 °C

说明

Application

This product is Informer compound X8 of the Aryl Halide Chemistry Informer Library developed by chemists at Merck & Co., Inc., Kenilworth, NJ, U.S., which contains 18 drug-like molecules representative of those encountered in complex synthesis. By screening a new reaction against the Informer Library, chemists can directly compare and analyse a reaction′s successes and shortcomings among different methods and various research teams. It may also be used to facilitate deeper method development for performance or utility.

Other Notes

Chemistry informer libraries: a chemoinformatics enabled approach to evaluate and advance synthetic methods, Chem. Sci., 2016, 7, 2604-2613

Synthesis of Complex Druglike Molecules by the Use of Highly Functionalized Bench-Stable Organozinc Reagents

Disclaimer

Not fully tested

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

法规信息

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Synthesis of Complex Druglike Molecules by the Use of Highly Functionalized Bench-Stable Organozinc Reagents.

Thomas J Greshock et al.

Angewandte Chemie (International ed. in English), 55(44), 13714-13718 (2016-10-22)

The reactivity of a representative set of 17 organozinc pivalates with 18 polyfunctional druglike electrophiles (informers) in Negishi cross-coupling reactions was evaluated by high-throughput experimentation protocols. The high-fidelity scaleup of successful reactions in parallel enabled the isolation of sufficient material

Chemistry informer libraries: a chemoinformatics enabled approach to evaluate and advance synthetic methods.

Peter S Kutchukian et al.

Chemical science, 7(4), 2604-2613 (2016-04-21)

Major new advances in synthetic chemistry methods are typically reported using simple, non-standardized reaction substrates, and reaction failures are rarely documented. This makes the evaluation and choice of a synthetic method difficult. We report a standardized complex molecule diagnostic approach

全球贸易项目编号

货号	GTIN
901735-100MG	04061835496433