Acetic Acid → HCID 9825493, compound

HRID 680998Notes

Reaction equation

HRID 680998 reaction equation
[CH3:31][C:32]([OH:33])=[O:34].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:27]([F:28])([F:29])[F:30])[n:10][n:11](-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:12]2-[c:13]2[cH:14][cH:15][c:16]([S:19][CH3:20])[cH:17][cH:18]2)[cH:6][cH:7]1.[OH2:37].[OH:35][OH:36]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[c:9]([C:27]([F:28])([F:29])[F:30])[n:10][n:11](-[c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[c:12]2-[c:13]2[cH:14][cH:15][c:16]([S:19]([CH3:20])(=[O:33])=[O:37])[cH:17][cH:18]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 784Hydrogen PeroxideHCID 962WaterHCID 15233411HCID 15233411, compound

Product 1

HCID 9825493HCID 9825493, compound

Sources & evidence

ORD record
ord-bf8d7fd52c6d4feaad2caeda05e04247
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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