Acetic Acid → HCID 25130139, compound

HRID 2135553Notes

Reaction equation

HRID 2135553 reaction equation
[Br-:17].[Br-:18].[Br-:19].[BrH:39].[C:1]([CH3:2])(=[O:3])[c:4]1[cH:5][c:6]([NH:10][C:11]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[cH:7][cH:8][cH:9]1.[C:40]([OH:41])(=[O:42])[CH3:43].[OH2:38].[nH+:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[nH+:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[nH+:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[C:1]([CH2:2][Br:17])(=[O:3])[c:4]1[cH:5][c:6]([NH:10][C:11]([C:12]([CH3:13])([CH3:14])[CH3:15])=[O:16])[cH:7][cH:8][cH:9]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 259Bromide ion3×HCID 260Hydrogen BromideHCID 962WaterHCID 3528238HCID 3528238, compoundHCID 4989215Pyridinium3×

Product 1

HCID 25130139HCID 25130139, compound

Sources & evidence

ORD record
ord-58906f25d1c442c2aadffdfafc2c49a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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