(Ethyl)[2-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-5-trifluoromethylbenzyl]carbamic acid benzyl ester → HCID 66607368, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([N:10]([CH2:11][c:12]1[c:13]([B:22]2[O:23][C:24]([CH3:25])([CH3:26])[C:27]([CH3:28])([CH3:29])[O:30]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1)[CH2:31][CH3:32])=[O:33].[CH2:34]([CH3:35])[O:36][C:37]([CH2:38][c:39]1[cH:40][c:41]([F:53])[cH:42][c:43]([O:45][S:46]([C:47]([F:48])([F:49])[F:50])(=[O:51])=[O:52])[cH:44]1)=[O:54]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9]([N:10]([CH2:11][c:12]1[c:13](-[c:43]2[cH:42][c:41]([F:53])[cH:40][c:39]([CH2:38][C:37]([O:36][CH2:34][CH3:35])=[O:54])[cH:44]2)[cH:14][cH:15][c:16]([C:18]([F:19])([F:20])[F:21])[cH:17]1)[CH2:31][CH3:32])=[O:33]Participants
3
Sources & evidence
- ORD record
- ord-ae3f8926c55a4a2789072e017bf4cb7a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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