Acetone → 6-(4-Acetylaminophenoxy)-hexanoic acid methyl ester

HRID 2340731Notes

Reaction equation

HRID 2340731 reaction equation
[Br:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[O:28][CH3:29].[CH3:1][C:2](=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([OH:9])[cH:10][cH:11]1.[CH3:30][C:31](=[O:32])[CH3:33].[I-:19].[K+:12].[K+:13].[Na+:18].[O-:14][C:15]([O-:16])=[O:17]>>[CH3:1][C:2](=[O:3])[NH:4][c:5]1[cH:6][cH:7][c:8]([O:9][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][C:26](=[O:27])[O:28][CH3:29])[cH:10][cH:11]1

Participants

8

Reactant 7

HCID 180AcetoneHCID 813Potassium Cation2×HCID 923Sodium ionHCID 1983AcetaminophenHCID 19660Carbonate IonHCID 30165Iodide IonHCID 4170292Methyl 6-Bromohexanoate

Product 1

HCID 497644916-(4-Acetylaminophenoxy)-hexanoic acid methyl ester

Sources & evidence

ORD record
ord-68a83fc953c14000b3801b7271ff044c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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