tert-Butanol → HCID 59369326, compound
Reaction equation
[Br:39][CH2:40][c:41]1[c:42](-[c:49]2[c:50]([Cl:56])[cH:51][cH:52][cH:53][c:54]2[Cl:55])[n:43][o:44][c:45]1[CH:46]1[CH2:47][CH2:48]1.[C:57]([OH:58])([CH3:59])([CH3:60])[CH3:61].[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][CH:14]([OH:18])[CH2:15][CH2:16][CH2:17]2)[cH:9][cH:10]1)=[O:19].[K:38].[O:20]1[CH2:21][CH2:22][O:23][CH2:24][CH2:25][O:26][CH2:27][CH2:28][O:29][CH2:30][CH2:31][O:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[O:62]1[CH2:63][CH2:64][CH2:65][CH2:66]1>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][cH:7][c:8]([N:11]2[CH2:12][CH2:13][CH:14]([O:18][CH2:40][c:41]3[c:42](-[c:49]4[c:50]([Cl:56])[cH:51][cH:52][cH:53][c:54]4[Cl:55])[n:43][o:44][c:45]3[CH:46]3[CH2:47][CH2:48]3)[CH2:15][CH2:16][CH2:17]2)[cH:9][cH:10]1)=[O:19]Participants
7
Sources & evidence
- ORD record
- ord-a0606191358a4e1780f7d6cceeb51c42
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
Loading…