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165740-12-5

165740-12-5 Structure

165740-12-5 Structure
IdentificationBack Directory
[Name]

1-?Piperidinecarboxylic acid, 4-?(3-?bromo-?8-?chloro-?5,?6-?dihydro-?11H-?benzo[5,?6]?cyclohepta[1,?2-?b]?pyridin-?11-?ylidene)?-?, ethyl ester
[CAS]

165740-12-5
[Synonyms]

Ethyl 4-(3-bromo-8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate
1-Piperidinecarboxylic acid, 4-(3-bromo-8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-, ethyl ester
[Molecular Formula]

C22H22BrClN2O2
[MDL Number]

MFCD20260305
[MOL File]

165740-12-5.mol
[Molecular Weight]

461.78
Chemical PropertiesBack Directory
[Melting point ]

355 °C
[Boiling point ]

554.2±50.0 °C(Predicted)
[density ]

1.444±0.06 g/cm3(Predicted)
[pka]

1.92±0.20(Predicted)
Hazard InformationBack Directory
[Uses]

This product is Informer compound X6 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 reactions′ 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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