Acetic Acid → Acetic Acid

HRID 1122298Notes

Reaction equation

HRID 1122298 reaction equation
[C:1]([CH3:2])(=[O:3])[OH:4].[CH3:5][c:6]1[cH:7][cH:8][c:9]([O:12][CH2:13][C:14]([CH:15]=[CH:16][c:17]2[cH:18][c:19]([CH3:25])[c:20]([OH:24])[c:21]([CH3:23])[cH:22]2)=[O:26])[cH:10][cH:11]1.[Na+:28].[OH-:27]>>[C:1]([CH3:2])(=[O:3])[OH:4].[cH:6]1[cH:7][cH:8][c:9]([O:12][CH2:13][C:14]([CH:15]=[CH:16][c:17]2[cH:18][c:19]([CH3:25])[c:20]([OH:24])[c:21]([CH3:23])[cH:22]2)=[O:26])[cH:10][cH:11]1

Participants

6

Reactant 4

HCID 176Acetic AcidHCID 923Sodium ionHCID 961HydroxideHCID 54308144HCID 54308144, compound

Product 2

HCID 176Acetic AcidHCID 57017415HCID 57017415, compound

Sources & evidence

ORD record
ord-ef1313ddd3274dc9aa7def8b54f8c8bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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