Methanol → Methanesulfonate

HRID 172558Notes

Reaction equation

HRID 172558 reaction equation
[C:6](#[N:7])[c:8]1[n:9](-[c:13]2[cH:14][c:15]([C:16](=[O:17])[N:18]=[C:19]([NH2:20])[NH2:21])[cH:22][cH:23][cH:24]2)[cH:10][cH:11][cH:12]1.[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:25][CH2:26][O:27][C:28](=[O:29])[CH3:30].[CH3:31][OH:32]>>[C:6](#[N:7])[c:8]1[n:9](-[c:13]2[cH:14][c:15]([C:16](=[O:17])[N:18]=[C:19]([NH2:20])[NH2:21])[cH:22][cH:23][cH:24]2)[cH:10][cH:11][cH:12]1.[CH3:1][S:2](=[O:3])(=[O:4])[O-:5]

Participants

6

Reactant 4

HCID 887MethanolHCID 6395Methanesulfonic AcidHCID 8857Ethyl AcetateHCID 189451892-[3-(2-Cyanopyrrol-1-yl)benzoyl]guanidine

Product 2

HCID 85257MethanesulfonateHCID 189451892-[3-(2-Cyanopyrrol-1-yl)benzoyl]guanidine

Sources & evidence

ORD record
ord-1644451cf0bf4563b25e85770ec2d0cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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