Isopropanol → Methanesulfonic Acid
Reaction equation
[CH3:1][S:2](=[O:3])(=[O:4])[O:5][CH2:6][CH:7]1[CH2:8][O:9][CH2:10][CH:11]=[C:12]1[c:13]1[cH:14][c:15]([Br:19])[cH:16][cH:17][cH:18]1.[CH3:24][C:25]#[N:26].[CH:27]([OH:28])([CH3:29])[CH3:30].[NH2:20][C:21]([NH2:22])=[S:23]>>[CH2:6]([CH:7]1[CH2:8][O:9][CH2:10][CH:11]=[C:12]1[c:13]1[cH:14][c:15]([Br:19])[cH:16][cH:17][cH:18]1)[S:23][C:21](=[NH:20])[NH2:22].[CH3:1][S:2](=[O:3])(=[O:4])[OH:5]Participants
6
Sources & evidence
- ORD record
- ord-75c5accd339a462dafe318138a599ee4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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