Toluene → HCID 178422784, compound
Reaction equation
[CH3:38][Al:39]([CH3:40])[CH3:41].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:27])[c:7]1[NH:8][c:9]1[nH:10][c:11]2[c:12]([n:13]1)[cH:14][c:15]([C:23]([O:25][CH3:24])=[O:26])[c:16]1[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]1.[F:28][c:29]1[c:30]([NH2:31])[cH:32][cH:33][c:34]([F:37])[c:35]1[F:36]>>[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:27])[c:7]1[NH:8][c:9]1[nH:10][c:11]2[c:12]([n:13]1)[cH:14][c:15]([C:23](=[O:25])[NH:31][c:30]1[c:29]([F:28])[c:35]([F:36])[c:34]([F:37])[cH:33][cH:32]1)[c:16]1[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]1Participants
5
Sources & evidence
- ORD record
- ord-dfb5dd312d434594882a89a072befaad
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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