Acetic Acid → HCID 18457039, compound

HRID 318930Notes

Reaction equation

HRID 318930 reaction equation
[CH3:28][C:29](=[O:30])[OH:31].[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]#[N:10])([CH:11]([CH3:12])[CH3:13])[c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)[cH:6][cH:7]1.[NH4+:26].[OH-:27].[S:21]([OH:22])(=[O:23])(=[O:24])[OH:25]>>[F:1][c:2]1[cH:3][cH:4][c:5]([C:8]([C:9]([NH2:10])=[O:22])([CH:11]([CH3:12])[CH3:13])[c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 223AmmoniumHCID 961HydroxideHCID 1118Sulfuric AcidHCID 18457040HCID 18457040, compound

Product 1

HCID 18457039HCID 18457039, compound

Sources & evidence

ORD record
ord-aa0995c91ae7490893e9dbf5f1da04c9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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