Acetonitrile → Methanesulfonic Acid

HRID 118691Notes

Reaction equation

HRID 118691 reaction equation
[CH3:37][S:38]([OH:39])(=[O:40])=[O:41].[CH3:42][C:43]#[N:44].[Cl:1][c:2]1[cH:3][c:4]([F:36])[c:5]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:6][c:7]1-[c:8]1[c:9](=[O:25])[n:10]([CH2:23][CH3:24])[c:11]2[cH:12][c:13]([NH:18][CH2:19][CH2:20][O:21][CH3:22])[n:14][cH:15][c:16]2[cH:17]1>>[CH3:37][S:38](=[O:39])(=[O:40])[OH:41].[Cl:1][c:2]1[cH:3][c:4]([F:36])[c:5]([NH:26][C:27](=[O:28])[NH:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[cH:6][c:7]1-[c:8]1[c:9](=[O:25])[n:10]([CH2:23][CH3:24])[c:11]2[cH:12][c:13]([NH:18][CH2:19][CH2:20][O:21][CH3:22])[n:14][cH:15][c:16]2[cH:17]1

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 6395Methanesulfonic AcidHCID 71584902HCID 71584902, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 71584902HCID 71584902, compound

Sources & evidence

ORD record
ord-6a262381c9404e9782c73159da21d182
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…