3-(Trifluoromethyl)phenyl isocyanate → 1-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-3-(3-(trifluoromethyl)phenyl)urea
Reaction equation
[CH3:1][C:2]1([CH3:16])[O:3][B:4]([c:9]2[cH:10][cH:11][c:12]([NH2:15])[cH:13][cH:14]2)[O:5][C:6]1([CH3:7])[CH3:8].[N:17](=[C:18]=[O:19])[c:20]1[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]1>>[CH3:1][C:2]1([CH3:16])[O:3][B:4]([c:9]2[cH:10][cH:11][c:12]([NH:15][C:18]([NH:17][c:20]3[cH:21][c:22]([C:26]([F:27])([F:28])[F:29])[cH:23][cH:24][cH:25]3)=[O:19])[cH:13][cH:14]2)[O:5][C:6]1([CH3:7])[CH3:8]Participants
3
Sources & evidence
- ORD record
- ord-3053ff7318e1464a8c47fe340df02da7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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