Acetic Acid → HCID 66990429, compound

HRID 109116Notes

Reaction equation

HRID 109116 reaction equation
[C:36].[CH3:38][CH:39]([OH:40])[CH3:41].[CH3:6][C:7](=[O:8])[OH:9].[CH:2]([O-:3])=[O:4].[F:10][CH:11]([O:12][c:13]1[c:14](-[c:19]2[cH:20][c:21]([N+:32]([O-:33])=[O:34])[c:22]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[cH:30][cH:31]2)[cH:15][cH:16][cH:17][cH:18]1)[F:35].[Na+:5].[OH2:1].[Pd:37]>>[F:10][CH:11]([O:12][c:13]1[c:14](-[c:19]2[cH:20][c:21]([NH2:32])[c:22]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[cH:30][cH:31]2)[cH:15][cH:16][cH:17][cH:18]1)[F:35]

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 283FormateHCID 297MethaneHCID 923Sodium ionHCID 962WaterHCID 3776IsopropanolHCID 23938PalladiumHCID 66990208HCID 66990208, compound

Product 1

HCID 66990429HCID 66990429, compound

Sources & evidence

ORD record
ord-9a0aee5cf18f429d8be735c3f7f6dc90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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