Benzene → Hydrochloric Acid
Reaction equation
[C:25]([CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])(=[O:35])[Cl:36].[OH:1][CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][N:8]([C:11]2=[N:17][c:16]3[c:15]([cH:21][cH:20][cH:19][cH:18]3)[NH:14][c:13]3[c:12]2[s:24][cH:23][cH:22]3)[CH2:9][CH2:10]1.[cH:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[ClH:36].[O:1]([CH2:2][CH2:3][CH2:4][N:5]1[CH2:6][CH2:7][N:8]([C:11]2=[N:17][c:16]3[c:15]([cH:21][cH:20][cH:19][cH:18]3)[NH:14][c:13]3[c:12]2[s:24][cH:23][cH:22]3)[CH2:9][CH2:10]1)[C:25]([CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34])=[O:35]Participants
5
Sources & evidence
- ORD record
- ord-1a8bd19a5fc94dd99a6fc508352680ac
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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