Ethanol → Methanesulfonic Acid

HRID 663219Notes

Reaction equation

HRID 663219 reaction equation
[CH3:33][OH:34].[CH3:35][S:36]([OH:37])(=[O:38])=[O:39].[CH3:40][CH2:41][OH:42].[Cl:1][c:2]1[c:3]([NH:23][C:24](=[O:25])[NH:26][c:27]2[n:28][o:29][c:30]([CH3:32])[cH:31]2)[cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][cH:11][n:12][c:13]3[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][c:18]23)[cH:7]1>>[CH3:35][S:36](=[O:37])(=[O:38])[OH:39].[Cl:1][c:2]1[c:3]([NH:23][C:24](=[O:25])[NH:26][c:27]2[n:28][o:29][c:30]([CH3:32])[cH:31]2)[cH:4][cH:5][c:6]([O:8][c:9]2[cH:10][cH:11][n:12][c:13]3[cH:14][c:15]([O:21][CH3:22])[c:16]([O:19][CH3:20])[cH:17][c:18]23)[cH:7]1

Participants

6

Reactant 4

HCID 702EthanolHCID 887MethanolHCID 6395Methanesulfonic AcidHCID 9911830Tivozanib

Product 2

HCID 6395Methanesulfonic AcidHCID 9911830Tivozanib

Sources & evidence

ORD record
ord-5757c05ac20e46f78b2ed7e4f3cc719b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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