Chloride → 4-Chloro-3-(3,3-dimethylbutyl)benzoic acid ethyl ester
Reaction equation
[CH2:22]1[O:23][CH2:24][CH2:25][O:26][CH2:27]1.[CH2:9]([CH3:10])[O:11][C:12]([c:13]1[cH:14][c:15]([Br:20])[c:16]([Cl:19])[cH:17][cH:18]1)=[O:21].[CH3:28][CH2:29][O:30][CH2:31][CH3:32].[CH3:2][C:3]([CH2:4][CH2:5][Mg+:6])([CH3:7])[CH3:8].[Cl-:1]>>[CH3:2][C:3]([CH2:4][CH2:5][c:15]1[cH:14][c:13]([C:12]([O:11][CH2:9][CH3:10])=[O:21])[cH:18][cH:17][c:16]1[Cl:19])([CH3:7])[CH3:8]Participants
6
Sources & evidence
- ORD record
- ord-5cba878196b541c2a1f3102077f802ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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