Acetic Acid → HCID 57772021, compound

HRID 201573Notes

Reaction equation

HRID 201573 reaction equation
[CH3:36][CH2:37][O:38][C:39]([CH3:40])=[O:41].[CH3:42][C:43](=[O:44])[OH:45].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12]3[c:13]([n:14]2[CH2:15][CH2:16][O:17][CH3:18])[c:19]([O:32][CH3:33])[cH:20][c:21]([CH2:23][c:24]2[c:25]([S:30][CH3:31])[cH:26][cH:27][cH:28][cH:29]2)[cH:22]3)[cH:8][cH:9]1.[OH:34][OH:35]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7](-[c:10]2[n:11][c:12]3[c:13]([n:14]2[CH2:15][CH2:16][O:17][CH3:18])[c:19]([O:32][CH3:33])[cH:20][c:21]([CH2:23][c:24]2[c:25]([S:30]([CH3:31])=[O:38])[cH:26][cH:27][cH:28][cH:29]2)[cH:22]3)[cH:8][cH:9]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 784Hydrogen PeroxideHCID 8857Ethyl AcetateHCID 57772063HCID 57772063, compound

Product 1

HCID 57772021HCID 57772021, compound

Sources & evidence

ORD record
ord-8b9be8793186463a93bb471a8353e078
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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