Acetic Acid → 4-(4'-Fluoro-4-biphenylyl)-butyric acid

HRID 1216656Notes

Reaction equation

HRID 1216656 reaction equation
[Ba+2:35].[CH3:26][C:27](=[O:28])[OH:29].[Cl+3:21]([OH:22])([O-:23])([O-:24])[O-:25].[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14]([CH2:15][CH2:16][C:17](=[O:18])[OH:19])=[O:20])[cH:12][cH:13]2)[cH:6][cH:7]1.[Pd+2:36].[S:30]([O-:31])([O-:32])(=[O:33])=[O:34].[S:37]([O-:38])([O-:39])(=[O:40])=[O:41]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH2:14][CH2:15][CH2:16][C:17](=[O:18])[OH:19])[cH:12][cH:13]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 1117Sulfate Ion2×HCID 24247Perchloric AcidHCID 104810Barium ionHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 107308704-(4'-Fluoro-4-biphenylyl)-4-oxo-butyric acid

Product 1

HCID 108487954-(4'-Fluoro-4-biphenylyl)-butyric acid

Sources & evidence

ORD record
ord-c32f17df45b44ce291ff26501e2a68ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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