Ammonia → p-Toluenesulfonic acid
Reaction equation
[CH3:25][CH2:26][OH:27].[ClH:11].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][C:9]#[N:10])[cH:6][cH:7]1.[NH3:12].[Na+:24].[OH2:28].[c:13]1([CH3:23])[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[O-:22])[cH:17][cH:18]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][C:9](=[NH:10])[NH2:12])[cH:6][cH:7]1.[c:13]1([CH3:23])[cH:14][cH:15][c:16]([S:19](=[O:20])(=[O:21])[OH:22])[cH:17][cH:18]1Participants
9
Sources & evidence
- ORD record
- ord-a293a3e44e76498aa24524389221ed01
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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