Isopropanol → HCID 178506375, compound
Reaction equation
[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:40][CH:41]([OH:42])[CH3:43].[Cl:23][c:24]1[c:25]2[nH:26][cH:27][n:28][c:29]2[n:30][cH:31][n:32]1.[F:1][C:2]([O:3][c:4]1[cH:5][c:6](-[c:10]2[n:11][c:12]([CH:15]3[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]3)[nH:13][cH:14]2)[cH:7][cH:8][cH:9]1)([F:21])[F:22]>>[F:1][C:2]([O:3][c:4]1[cH:5][c:6](-[c:10]2[n:11][c:12]([CH:15]3[CH2:16][CH2:17][N:18]([c:24]4[c:25]5[nH:26][cH:27][n:28][c:29]5[n:30][cH:31][n:32]4)[CH2:19][CH2:20]3)[nH:13][cH:14]2)[cH:7][cH:8][cH:9]1)([F:21])[F:22]Participants
5
Sources & evidence
- ORD record
- ord-afe74d456b6d4763ad6d0f28ce3a554e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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