Acetic Acid → HCID 18355378, compound

HRID 154414Notes

Reaction equation

HRID 154414 reaction equation
[CH3:30][C:31]([O:32][C:33](=[O:34])[CH3:35])=[O:36].[CH3:37][C:38](=[O:39])[OH:40].[Cl:1][c:2]1[n:3][n:4](-[c:17]2[cH:18][c:19]([O:23][CH3:24])[cH:20][cH:21][cH:22]2)[c:5](-[c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[cH:6]1.[OH2:29].[OH:25][N+:26]([O-:27])=[O:28]>>[Cl:1][c:2]1[n:3][n:4](-[c:17]2[cH:18][c:19]([O:23][CH3:24])[c:20]([N+:26](=[O:25])[O-:27])[cH:21][cH:22]2)[c:5](-[c:7]2[cH:8][cH:9][c:10]([S:13](=[O:14])(=[O:15])[CH3:16])[cH:11][cH:12]2)[cH:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 944Nitric AcidHCID 962WaterHCID 7918Acetic AnhydrideHCID 9799089HCID 9799089, compound

Product 1

HCID 18355378HCID 18355378, compound

Sources & evidence

ORD record
ord-3bb687eb5a274d27880b832a8bd42086
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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