| Identification | Back Directory | [Name]
1-Pyrrolidinecarboxylic acid, 2-[(5-bromo-1H-indol-3-yl)carbonyl]-, phenylmethyl ester, (S)- | [CAS]
199659-03-5 | [Synonyms]
(S)-benzyl 2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate
Benzyl (S)-2-(5-bromo-1H-indole-3-carbonyl)pyrrolidine-1-carboxylate
1-Pyrrolidinecarboxylic acid, 2-[(5-bromo-1H-indol-3-yl)carbonyl]-, phenylmethyl ester, (S)-
1-Pyrrolidinecarboxylic acid, 2-[(5-bromo-1H-indol-3-yl)carbonyl]-, phenylmethyl ester, (2S)- | [Molecular Formula]
C21H19BrN2O3 | [MOL File]
199659-03-5.mol | [Molecular Weight]
427.29 |
| Chemical Properties | Back Directory | [Melting point ]
191 °C | [Boiling point ]
605.0±55.0 °C(Predicted) | [density ]
1.505±0.06 g/cm3(Predicted) | [storage temp. ]
Storage temp. 2-8°C | [solubility ]
DCM, Methanol | [form ]
Oil | [pka]
14.40±0.30(Predicted) | [color ]
Brown | [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 | [InChIKey]
CWHKVBJSRGJFFN-IBGZPJMESA-N | [SMILES]
Brc1cc2c([nH]cc2C(=O)[C@H]3N(CCC3)C(=O)OCc4ccccc4)cc1 |
| Hazard Information | Back Directory | [Uses]
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. |
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| Company Name: |
Sigma-Aldrich
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| Telephone: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
| Company Name: |
Energy Chemical
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| Telephone: |
021-58432009 400-005-6266 |
| Website: |
http://www.energy-chemical.com |
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