Acetic Acid → HCID 53979181, compound

HRID 1202169Notes

Reaction equation

HRID 1202169 reaction equation
[CH3:1][C:2]1([CH3:26])[c:3]2[cH:4][cH:5][c:6]([C:14](=[CH:15][c:16]3[cH:17][cH:18][c:19]([S:22](=[O:23])[O-:24])[cH:20][cH:21]3)[CH3:25])[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1.[CH3:28][CH2:29][OH:30].[CH3:36][C:37](=[O:38])[OH:39].[CH:31](=[CH2:32])[C:33](=[O:34])[CH3:35].[Na+:27]>>[CH3:1][C:2]1([CH3:26])[c:3]2[cH:4][cH:5][c:6]([C:14](=[CH:15][c:16]3[cH:17][cH:18][c:19]([S:22](=[O:23])(=[O:24])[CH2:32][CH2:31][C:33](=[O:34])[CH3:35])[cH:20][cH:21]3)[CH3:25])[cH:7][c:8]2[C:9]([CH3:12])([CH3:13])[CH2:10][CH2:11]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 6570Methyl vinyl ketoneHCID 178439338HCID 178439338, compound

Product 1

HCID 53979181HCID 53979181, compound

Sources & evidence

ORD record
ord-a89c6294b5e649f396bf4dbc4e41298c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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