Acetic Acid → HCID 178494543, compound

HRID 682053Notes

Reaction equation

HRID 682053 reaction equation
[CH3:1][O:2][CH2:3][c:4]1[cH:5][c:6]([NH2:24])[c:7]2[c:8]([n:9][c:10](-[c:13]3[n:14][cH:15][cH:16][cH:17][c:18]3[C:19]([F:20])([F:21])[F:22])[cH:11][n:12]2)[n:23]1.[CH3:29][C:30](=[O:31])[OH:32].[N:25](=[O:26])[O-:27].[Na+:28].[OH2:33]>>[CH3:1][O:2][CH2:3][c:4]1[cH:5][c:6]([OH:26])[c:7]2[c:8]([n:9][c:10](-[c:13]3[n:14][cH:15][cH:16][cH:17][c:18]3[C:19]([F:20])([F:21])[F:22])[cH:11][n:12]2)[n:23]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 57561041HCID 57561041, compound

Product 1

HCID 178494543HCID 178494543, compound

Sources & evidence

ORD record
ord-a767133d4a584038a003da0e0ab5f17c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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