Phenol → HCID 23160380, compound
Reaction equation
[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[Cl:1][c:2]1[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][cH:9][c:10]([Cl:12])[n:11]2.[OH:23][c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1.[n:13]1[c:14]([NH2:22])[s:15][c:16]2[n:17][cH:18][cH:19][cH:20][c:21]12>>[c:2]1([NH:22][c:14]2[n:13][c:21]3[c:16]([s:15]2)[n:17][cH:18][cH:19][cH:20]3)[c:3]2[c:4]([n:5][cH:6][n:7]1)[cH:8][cH:9][c:10]([Cl:12])[n:11]2Participants
5
Sources & evidence
- ORD record
- ord-fda37ca81da44cdc9d4918c8b4ce8e90
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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