1-Butanol → HCID 178493051, compound
Reaction equation
[CH2:37]([OH:38])[CH2:39][CH2:40][CH3:41].[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36].[Cl:12][c:13]1[n:14][c:15]([Cl:27])[cH:16][c:17]([NH:19][c:20]2[n:21][nH:22][c:23]([O:25][CH3:26])[cH:24]2)[n:18]1.[ClH:1].[F:2][c:3]1[cH:4][n:5][c:6]([CH:9]([CH3:10])[NH2:11])[n:7][cH:8]1>>[F:2][c:3]1[cH:4][n:5][c:6]([CH:9]([CH3:10])[NH:11][c:13]2[n:14][c:15]([Cl:27])[cH:16][c:17]([NH:19][c:20]3[n:21][nH:22][c:23]([O:25][CH3:26])[cH:24]3)[n:18]2)[n:7][cH:8]1Participants
6
Sources & evidence
- ORD record
- ord-995c5c0f54d34ab4ba73ecbb4b21d905
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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