Benzene → 4-Acetoxy-5-[4-(4-trifluoromethylphenoxy)phenoxy]-2-hexanone
Reaction equation
[CH3:33][C:34]([Cl:35])=[O:36].[OH:1][CH:2]([CH2:3][C:4]([CH3:5])=[O:6])[CH:7]([CH3:8])[O:9][c:10]1[cH:11][cH:12][c:13]([O:16][c:17]2[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]2)[cH:14][cH:15]1.[cH:27]1[cH:28][cH:29][n:30][cH:31][cH:32]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[O:1]([CH:2]([CH2:3][C:4]([CH3:5])=[O:6])[CH:7]([CH3:8])[O:9][c:10]1[cH:11][cH:12][c:13]([O:16][c:17]2[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]2)[cH:14][cH:15]1)[C:34]([CH3:33])=[O:36]Participants
5
Sources & evidence
- ORD record
- ord-c65abc0405a8436bae1d2504fa127f8e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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