Acetic Acid → Benzenebutanoic acid, 4-cyclohexyl-

HRID 111343Notes

Reaction equation

HRID 111343 reaction equation
[C:25].[CH3:27][C:28](=[O:29])[OH:30].[CH:1]1([c:7]2[cH:8][cH:9][c:10]([C:11](=[O:12])[CH2:13][CH2:14][C:15](=[O:16])[OH:17])[cH:18][cH:19]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl+3:20]([OH:21])([O-:22])([O-:23])[O-:24].[Pd:26]>>[CH:1]1([c:7]2[cH:8][cH:9][c:10]([CH2:11][CH2:13][CH2:14][C:15](=[O:16])[OH:17])[cH:18][cH:19]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 297MethaneHCID 23938PalladiumHCID 24247Perchloric AcidHCID 1618624-(4-Cyclohexylphenyl)-4-oxobutanoic acid

Product 1

HCID 3041568Benzenebutanoic acid, 4-cyclohexyl-

Sources & evidence

ORD record
ord-5700379b5a0c4c8eb5feb46b2e74506e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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