Acetonitrile → Methanesulfonic Acid

HRID 1205334Notes

Reaction equation

HRID 1205334 reaction equation
[CH2:1]([CH3:2])[n:3]1[c:4](=[O:36])[c:5](-[c:18]2[c:19]([F:35])[cH:20][c:21]([F:34])[c:22]([NH:24][C:25](=[O:26])[NH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:23]2)[cH:6][c:7]2[cH:8][n:9][c:10]([NH:13][CH2:14][CH2:15][O:16][CH3:17])[cH:11][c:12]12.[CH3:37][S:38]([OH:39])(=[O:40])=[O:41].[CH3:42][C:43]#[N:44]>>[CH2:1]([CH3:2])[n:3]1[c:4](=[O:36])[c:5](-[c:18]2[c:19]([F:35])[cH:20][c:21]([F:34])[c:22]([NH:24][C:25](=[O:26])[NH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:23]2)[cH:6][c:7]2[cH:8][n:9][c:10]([NH:13][CH2:14][CH2:15][O:16][CH3:17])[cH:11][c:12]12.[CH3:37][S:38](=[O:39])(=[O:40])[OH:41]

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 6395Methanesulfonic AcidHCID 71584958HCID 71584958, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 71584958HCID 71584958, compound

Sources & evidence

ORD record
ord-80fcebb5cae24db7b498503e7a102650
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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