Acetic Acid → HCID 178474187, compound

HRID 2333749Notes

Reaction equation

HRID 2333749 reaction equation
[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([CH2:9][N:10]2[C:11](=[O:22])[CH:12]([NH:15][C:16]([C:17]([F:18])([F:19])[F:20])=[O:21])[CH2:13][CH2:14]2)[cH:23][cH:24]1.[C:36]([OH:37])(=[O:38])[CH3:39].[CH3:25][C:26]([O:27][C:28](=[O:29])[CH3:30])=[O:31].[N:32](=[O:33])[O-:34].[Na+:35].[OH2:40]>>[C:1]([CH3:2])(=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([CH2:9][N:10]2[C:11](=[O:22])[CH:12]([NH:15][C:16]([C:17]([F:18])([F:19])[F:20])=[O:21])[CH2:13][CH2:14]2)[cH:23][c:24]1[N+:32](=[O:33])[O-:34]

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 946NitriteHCID 962WaterHCID 7918Acetic AnhydrideHCID 178474186HCID 178474186, compound

Product 1

HCID 178474187HCID 178474187, compound

Sources & evidence

ORD record
ord-811325e8541d42739bf6a2c66dc4afe1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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