Acetic Acid → HCID 13851175, compound

HRID 215113Notes

Reaction equation

HRID 215113 reaction equation
[CH3:38][CH2:39][OH:40].[CH3:41][C:42](=[O:43])[OH:44].[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][n:16]3[c:17](=[S:30])[nH:18][c:19]4[cH:20][c:21]([N+:27](=[O:28])[O-:29])[cH:22][cH:23][c:24]4[c:25]3=[O:26])[CH2:12][CH2:13]2)[cH:31][cH:32]1.[K+:34].[OH-:33].[OH2:35].[OH:36][OH:37]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:6](=[O:7])[CH:8]2[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][n:16]3[c:17](=[O:33])[nH:18][c:19]4[cH:20][c:21]([N+:27](=[O:28])[O-:29])[cH:22][cH:23][c:24]4[c:25]3=[O:26])[CH2:12][CH2:13]2)[cH:31][cH:32]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 784Hydrogen PeroxideHCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 20202883HCID 20202883, compound

Product 1

HCID 13851175HCID 13851175, compound

Sources & evidence

ORD record
ord-970ca25612e34908af0021b2bcc30356
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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