Methanol → Methanesulfonic Acid
Reaction equation
[C:6]([CH3:7])([CH3:8])([CH3:9])[c:10]1[cH:11][c:12]([NH:22][C:23](=[O:24])[NH:25][c:26]2[cH:27][n:28][c:29]([N:32]3[CH2:33][CH2:34][N:35]([C:38]([CH2:39][CH:40]4[CH2:41][CH2:42][CH2:43][CH2:44]4)=[O:45])[CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:13](-[c:15]2[cH:16][cH:17][c:18]([CH3:21])[cH:19][cH:20]2)[n:14]1.[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:48][CH2:49][O:50][CH2:51][CH3:52].[CH3:56][OH:57].[Cl:53][CH2:54][Cl:55].[N:46]#[N:47]>>[C:6]([CH3:7])([CH3:8])([CH3:9])[c:10]1[cH:11][c:12]([NH:22][C:23](=[O:24])[NH:25][c:26]2[cH:27][n:28][c:29]([N:32]3[CH2:33][CH2:34][N:35]([C:38]([CH2:39][CH:40]4[CH2:41][CH2:42][CH2:43][CH2:44]4)=[O:45])[CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:13](-[c:15]2[cH:16][cH:17][c:18]([CH3:21])[cH:19][cH:20]2)[n:14]1.[CH3:1][S:2](=[O:3])(=[O:4])[OH:5]Participants
8
Sources & evidence
- ORD record
- ord-ba231b78e2d04bab84bfbf67aff34c5e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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