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Hydrochloric Acid → 8-bromo-2-((tert-butoxycarbonyl)amino)-3H-benzo[b]azepine-4-carboxylic acid

HRID 2152028
Notes
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Reaction equation

HRID 2152028 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:25]1)[N:7]=[C:8]([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:9][C:10]([C:12](=[O:13])[O:14][CH2:15][CH3:16])=[CH:11]2.[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:35][C:36]#[N:37].[ClH:29].[Na+:27].[OH-:26].[OH2:28]>>[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:25]1)[N:7]=[C:8]([NH:17][C:18](=[O:19])[O:20][C:21]([CH3:22])([CH3:23])[CH3:24])[CH2:9][C:10]([C:12](=[O:13])[OH:14])=[CH:11]2
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 6342AcetonitrileHCID 8028TetrahydrofuranHCID 58228529Ethyl 8-bromo-2-((tert-butoxycarbonyl)amino)-3H-benzo[b]azepine-4-carboxylate

Product 1

Sources & evidence

ORD record
ord-efebf059e8964bde833f47c4f6d91ea9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes
HCID 669596238-bromo-2-((tert-butoxycarbonyl)amino)-3H-benzo[b]azepine-4-carboxylic acid