Bromide ion → 3-Chloro-6-(3,5-diisopropylphenoxy)benzoic Acid
Reaction equation
[Br-:27].[CH:12]([CH3:13])([CH3:14])[c:15]1[cH:16][c:17]([OH:24])[cH:18][c:19]([CH:21]([CH3:22])[CH3:23])[cH:20]1.[Cl:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([Cl:11])[cH:9][cH:10]1.[H-:25].[Na+:26].[c:28]1([CH3:29])[c:30]([CH3:31])[cH:32][cH:33][cH:34][cH:35]1>>[c:2]1([O:24][c:17]2[cH:16][c:15]([CH:12]([CH3:13])[CH3:14])[cH:20][c:19]([CH:21]([CH3:22])[CH3:23])[cH:18]2)[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([Cl:11])[cH:9][cH:10]1Participants
7
Sources & evidence
- ORD record
- ord-e80620ead0d244bcabd2a17e4c4c2781
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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