Water → Methanesulfonic Acid

HRID 667310Notes

Reaction equation

HRID 667310 reaction equation
[CH3:41][S:42]([OH:43])(=[O:44])=[O:45].[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7].[N+:8](=[O:9])([O-:10])[c:11]1[cH:12][c:13]([CH:17]([CH2:18][C:19](=[O:20])[OH:21])[NH:22][C:23]([CH2:24][NH:25][C:26]([CH2:27][CH2:28][CH2:29][CH2:30][NH:31][c:32]2[n:33][cH:34][cH:35][c:36]([CH3:38])[cH:37]2)=[O:39])=[O:40])[cH:14][cH:15][cH:16]1.[OH2:46]>>[CH3:41][S:42](=[O:43])(=[O:44])[OH:45].[N+:8](=[O:9])([O-:10])[c:11]1[cH:12][c:13]([CH:17]([CH2:18][C:19](=[O:20])[OH:21])[NH:22][C:23]([CH2:24][NH:25][C:26]([CH2:27][CH2:28][CH2:29][CH2:30][NH:31][c:32]2[n:33][cH:34][cH:35][c:36]([CH3:38])[cH:37]2)=[O:39])=[O:40])[cH:14][cH:15][cH:16]1

Participants

6

Reactant 4

HCID 962WaterHCID 6395Methanesulfonic AcidHCID 6422Trifluoroacetic acidHCID 18518009HCID 18518009, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 18518009HCID 18518009, compound

Sources & evidence

ORD record
ord-69a067860b894da6a8ccb1fc08168909
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…