Acetic Acid → HCID 14839521, compound

HRID 283872Notes

Reaction equation

HRID 283872 reaction equation
[Br-:28].[BrH:23].[CH3:30][C:31](=[O:32])[OH:33].[N:24]([O-:25])=[O:26].[NH2:1][c:2]1[cH:3][c:4](-[c:13]2[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][cH:18]2)[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1.[Na+:27].[OH2:29]>>[c:2]1([Br:23])[cH:3][c:4](-[c:13]2[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][cH:18]2)[c:5]([C:6](=[O:7])[O:8][CH2:9][CH3:10])[cH:11][cH:12]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 259Bromide ionHCID 260Hydrogen BromideHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 14839523HCID 14839523, compound

Product 1

HCID 14839521HCID 14839521, compound

Sources & evidence

ORD record
ord-29cfc7bdf4b4425c8d8e0d12481371c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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