Acetate → HCID 178468346, compound

HRID 118590Notes

Reaction equation

HRID 118590 reaction equation
[CH3:15][C:16](=[O:17])[O-:18].[CH3:19][C:20](=[O:21])[CH2:22][C:23]([CH3:24])=[O:25].[CH3:26][C:27](=[O:28])[OH:29].[ClH:30].[F:1][c:2]1[c:3]([NH2:4])[cH:5][cH:6][c:7]([F:9])[cH:8]1.[N:10]([O-:11])=[O:12].[Na+:13].[Na+:14].[OH2:31]>>[F:1][c:2]1[c:3]([NH:4][N:10]=[C:22]([C:20]([CH3:19])=[O:21])[C:23]([CH3:24])=[O:25])[cH:5][cH:6][c:7]([F:9])[cH:8]1

Participants

9

Reactant 8

HCID 175AcetateHCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 946NitriteHCID 962WaterHCID 97092,4-DifluoroanilineHCID 31261Acetylacetone

Product 1

HCID 178468346HCID 178468346, compound

Sources & evidence

ORD record
ord-5e1653623ce94a88a7c1b05603af0c47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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