Acetic Acid → HCID 178504978, compound

HRID 188220Notes

Reaction equation

HRID 188220 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[OH2:29].[OH:1][c:2]1[o:3][c:4]2[c:5]([c:6](=[O:8])[cH:7]1)[cH:9][c:10]([O:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:11]([NH:13][S:14](=[O:15])(=[O:16])[CH3:17])[cH:12]2.[OH:25][N+:26]([O-:27])=[O:28]>>[OH:1][c:2]1[o:3][c:4]2[c:5]([c:6](=[O:8])[c:7]1[N+:26](=[O:25])[O-:27])[cH:9][c:10]([O:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[c:11]([NH:13][S:14](=[O:15])(=[O:16])[CH3:17])[cH:12]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 944Nitric AcidHCID 962WaterHCID 178504976HCID 178504976, compound

Product 1

HCID 178504978HCID 178504978, compound

Sources & evidence

ORD record
ord-976a37efc4754871a5001aff157ce4f3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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