4-(Trifluoromethyl)phenylboronic acid → HCID 66657676, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[n:8](-[c:16]2[cH:17][cH:18][c:19]3[n:20]([CH2:29][CH3:30])[c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]4[c:27]3[cH:28]2)[c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][c:14]12.[F:37][C:38]([c:39]1[cH:40][cH:41][c:42]([B:45]([OH:46])[OH:47])[cH:43][cH:44]1)([F:48])[F:49]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH2:31][C:32](=[O:33])[O:34][CH2:35][CH3:36])[n:8](-[c:16]2[cH:17][cH:18][c:19]3[n:20]([CH2:29][CH3:30])[c:21]4[cH:22][cH:23][cH:24][cH:25][c:26]4[c:27]3[cH:28]2)[c:9]2[cH:10][cH:11][c:12]([O:15][c:42]3[cH:41][cH:40][c:39]([C:38]([F:37])([F:48])[F:49])[cH:44][cH:43]3)[cH:13][c:14]12Participants
3
Sources & evidence
- ORD record
- ord-d346b9efd7464d16b9ca4765a1764e05
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…