Ethanol → Methanesulfonic Acid

HRID 2133029Notes

Reaction equation

HRID 2133029 reaction equation
[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:31][CH2:32][O:33][CH2:34][CH3:35].[CH3:36][CH2:37][OH:38].[CH3:6][N:7]([c:8]1[n:9][cH:10][cH:11][cH:12][cH:13]1)[CH2:14][CH2:15][O:16][c:17]1[cH:18][cH:19][c:20]([CH2:21][CH:22]2[C:23](=[O:28])[NH:24][C:25](=[O:27])[S:26]2)[cH:29][cH:30]1>>[CH3:1][S:2](=[O:3])(=[O:4])[OH:5].[CH3:6][N:7]([c:8]1[n:9][cH:10][cH:11][cH:12][cH:13]1)[CH2:14][CH2:15][O:16][c:17]1[cH:18][cH:19][c:20]([CH2:21][CH:22]2[C:23](=[O:28])[NH:24][C:25](=[O:27])[S:26]2)[cH:29][cH:30]1

Participants

6

Reactant 4

HCID 702EthanolHCID 3283Diethyl EtherHCID 6395Methanesulfonic AcidHCID 77999Rosiglitazone

Product 2

HCID 6395Methanesulfonic AcidHCID 77999Rosiglitazone

Sources & evidence

ORD record
ord-a0ddef533933462abf1bee9e145e48a6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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