Ethanol → p-Toluenesulfonic acid
Reaction equation
[CH3:39][CH2:40][OH:41].[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][n:10][c:11]([C:13]([O:15][CH2:14][CH3:16])=[O:17])[o:12]2)[cH:5][cH:6][cH:7]1.[NH2:18][CH:19]1[CH2:20][N:21]2[CH2:22][CH2:23][CH:24]1[CH2:25][CH2:26]2.[OH2:27].[c:28]1([CH3:38])[cH:29][cH:30][c:31]([S:34](=[O:35])(=[O:36])[OH:37])[cH:32][cH:33]1>>[Cl:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][n:10][c:11]([C:13](=[O:15])[NH:18][CH:19]3[CH2:20][N:21]4[CH2:22][CH2:23][CH:24]3[CH2:25][CH2:26]4)[o:12]2)[cH:5][cH:6][cH:7]1.[c:28]1([CH3:38])[cH:29][cH:30][c:31]([S:34](=[O:35])(=[O:36])[OH:37])[cH:32][cH:33]1Participants
7
Sources & evidence
- ORD record
- ord-9fa0936cdc56433096e5893b1785a3fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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