Acetic Acid → HCID 54734732, compound

HRID 179517Notes

Reaction equation

HRID 179517 reaction equation
[CH3:18][C:19]([OH:20])=[O:21].[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[CH3:29][CH2:30][OH:31].[OH:16][OH:17].[OH:1][c:2]1[c:3]([S:10][CH2:11][CH2:12][CH:13]([CH3:14])[CH3:15])[c:4](=[O:9])[o:5][c:6]([CH3:8])[cH:7]1>>[OH:1][c:2]1[c:3]([S:10]([CH2:11][CH2:12][CH:13]([CH3:14])[CH3:15])=[O:20])[c:4](=[O:9])[o:5][c:6]([CH3:8])[cH:7]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 702EthanolHCID 784Hydrogen PeroxideHCID 1140TolueneHCID 54735605HCID 54735605, compound

Product 1

HCID 54734732HCID 54734732, compound

Sources & evidence

ORD record
ord-9570a2f3672c468583df6d01a3afdd35
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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