901719
Benzyl (S)-2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate
别名:
Aryl halide chemistry informer library compound X5
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关于此项目
经验公式（希尔记法）:
C21H19BrN2O3
化学文摘社编号:
分子量:
427.29
MDL number:
UNSPSC Code:
12352101
NACRES:
NA.22
Form:
powder or crystals
form
powder or crystals
mp
191 °C
SMILES string
Brc1cc2c([nH]cc2C(=O)[C@H]3N(CCC3)C(=O)OCc4ccccc4)cc1
InChI
1S/C21H19BrN2O3/c22-15-8-9-18-16(11-15)17(12-23-18)20(25)19-7-4-10-24(19)21(26)27-13-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,19,23H,4,7,10,13H2/t19-/m0/s1
InChI key
CWHKVBJSRGJFFN-IBGZPJMESA-N
Application
This product is Informer compound X5 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
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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