Acetone → 3-(3-Oxo-butyryl)-benzoic acid methyl ester

HRID 95837

Reaction equation

HRID 95837 reaction equation
[C:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[O:7][CH3:8])[cH:9][cH:10][cH:11]1)([O:13][CH3:12])=[O:14].[CH3:15][C:16]([CH3:17])=[O:18].[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[ClH:21].[H-:20].[Na+:19].[OH2:29]>>[C:1]([c:2]1[cH:3][c:4]([C:5](=[O:6])[O:7][CH3:8])[cH:9][cH:10][cH:11]1)(=[O:13])[CH2:15][C:16]([CH3:17])=[O:18]

Participants

8

Sources & evidence

ORD record
ord-f9e931d4dc7a4eb3b674d5b121f1e523
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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