Acetic Acid → Hydrogen Bromide

HRID 94838Notes

Reaction equation

HRID 94838 reaction equation
[BrH:35].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7]([CH2:22][CH2:23][NH:24][C:25]([O:26][CH2:27][c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)=[O:34])[c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][c:14]12.[CH3:36][C:37](=[O:38])[OH:39]>>[BrH:35].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7]([CH2:22][CH2:23][NH2:24])[c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][c:14]12

Participants

5

Reactant 3

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 537083492-{2-[(Benzyloxycarbonyl)amino]ethyl}-5-chloro-3-phenylisoindole-1-carboxylic acid ethyl ester

Product 2

HCID 260Hydrogen BromideHCID 541877222-(2-Aminoethyl)-5-chloro-3-phenylisoindole-1-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-a19675b77a504dd8aaa24e9ca6bfe154
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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