Methanol → 2-Hexanone, 4-hydroxy-5-[4-[4-(trifluoromethyl)phenoxy]phenoxy]-
Reaction equation
[CH3:1][N:2]([CH3:3])[N:29]=[C:4]([CH3:5])[CH2:6][CH:7]([CH:8]([CH3:9])[O:10][c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[cH:15][cH:16]1)[OH:28].[CH3:36][OH:37].[I+3:30]([O-:31])([O-:32])([O-:33])[O-:34].[Na+:35].[O-:38][P:39](=[O:40])([O-:41])[O-:42].[OH2:43]>>[C:4]([CH3:5])([CH2:6][CH:7]([CH:8]([CH3:9])[O:10][c:11]1[cH:12][cH:13][c:14]([O:17][c:18]2[cH:19][cH:20][c:21]([C:24]([F:25])([F:26])[F:27])[cH:22][cH:23]2)[cH:15][cH:16]1)[OH:28])=[O:31]Participants
7
Sources & evidence
- ORD record
- ord-f92b235b1c9a4d399c30b8a054d799f7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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