Acetic Acid → HCID 10095397, compound

HRID 184454Notes

Reaction equation

HRID 184454 reaction equation
[BrH:36].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([CH2:21][CH2:22][N:23]3[CH2:24][CH2:25][N:26]([c:29]4[n:30][cH:31][cH:32][c:33]([CH3:35])[cH:34]4)[CH2:27][CH2:28]3)[c:11]3[cH:12][cH:13][cH:14][c:15]4[c:20]3[n:19]2[CH2:18][CH2:17][CH2:16]4)[cH:7][cH:8]1.[CH3:39][C:40](=[O:41])[OH:42].[Na+:38].[OH-:37].[OH2:43]>>[OH:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[c:10]([CH2:21][CH2:22][N:23]3[CH2:24][CH2:25][N:26]([c:29]4[n:30][cH:31][cH:32][c:33]([CH3:35])[cH:34]4)[CH2:27][CH2:28]3)[c:11]3[cH:12][cH:13][cH:14][c:15]4[c:20]3[n:19]2[CH2:18][CH2:17][CH2:16]4)[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 260Hydrogen BromideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 10389831HCID 10389831, compound

Product 1

HCID 10095397HCID 10095397, compound

Sources & evidence

ORD record
ord-62e50bbef4f04dcfaebaeb52171326b0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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