Acetic Acid → Hydrogen Bromide

HRID 1210918Notes

Reaction equation

HRID 1210918 reaction equation
[BrH:49].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH:7]([NH:8][C:9]([CH2:10][N:11]([CH:12]1[CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2[CH2:20]1)[C:21]([CH:22]([NH:23][CH:24]([CH2:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH3:38])=[O:39])=[O:40])[CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)=[O:48].[CH3:50][C:51](=[O:52])[OH:53]>>[BrH:49].[O:5]=[C:6]([CH:7]([NH:8][C:9]([CH2:10][N:11]([CH:12]1[CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2[CH2:20]1)[C:21]([CH:22]([NH:23][CH:24]([CH2:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[C:33](=[O:34])[O:35][CH2:36][CH3:37])[CH3:38])=[O:39])=[O:40])[CH2:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1)[OH:48]

Participants

5

Reactant 3

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 178471241HCID 178471241, compound

Product 2

HCID 260Hydrogen BromideHCID 178471240HCID 178471240, compound

Sources & evidence

ORD record
ord-27e0d8ff5bae4629bf43e76557cb0641
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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