Ethanol → Methanesulfonic Acid

HRID 2349203Notes

Reaction equation

HRID 2349203 reaction equation
[CH3:35][S:36]([OH:37])(=[O:38])=[O:39].[CH3:40][CH2:41][OH:42].[CH:1]1([c:7]2[n:8][n:9]([CH3:34])[c:10]3[n:11][c:12](-[c:17]4[c:18]([O:32][CH3:33])[cH:19][c:20]([N:23]5[CH2:24][CH2:25][CH:26]([N:29]([CH3:30])[CH3:31])[CH2:27][CH2:28]5)[cH:21][cH:22]4)[nH:13][c:14](=[O:16])[c:15]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH3:35][S:36](=[O:37])(=[O:38])[OH:39].[CH:1]1([c:7]2[n:8][n:9]([CH3:34])[c:10]3[n:11][c:12](-[c:17]4[c:18]([O:32][CH3:33])[cH:19][c:20]([N:23]5[CH2:24][CH2:25][CH:26]([N:29]([CH3:30])[CH3:31])[CH2:27][CH2:28]5)[cH:21][cH:22]4)[nH:13][c:14](=[O:16])[c:15]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

5

Reactant 3

HCID 702EthanolHCID 6395Methanesulfonic AcidHCID 136005798HCID 136005798, compound

Product 2

HCID 6395Methanesulfonic AcidHCID 136005798HCID 136005798, compound

Sources & evidence

ORD record
ord-1b1d4f5bfeff45b88782b24b94122170
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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