Ethanol → Methanesulfonic Acid

HRID 1547316Notes

Reaction equation

HRID 1547316 reaction equation
[CH3:28][S:29]([OH:30])(=[O:31])=[O:32].[CH3:33][CH2:34][OH:35].[n:1]1[cH:2][c:3]([CH2:7][CH:8]2[N:9]3[CH2:10][CH2:11][CH:12]([CH:13]2[NH:14][C:15](=[O:16])[c:17]2[o:18][c:19]4[c:20]([cH:21]2)[cH:22][cH:23][cH:24][cH:25]4)[CH2:26][CH2:27]3)[cH:4][cH:5][cH:6]1>>[CH3:28][S:29](=[O:30])(=[O:31])[OH:32].[n:1]1[cH:2][c:3]([CH2:7][CH:8]2[N:9]3[CH2:10][CH2:11][CH:12]([CH:13]2[NH:14][C:15](=[O:16])[c:17]2[o:18][c:19]4[c:20]([cH:21]2)[cH:22][cH:23][cH:24][cH:25]4)[CH2:26][CH2:27]3)[cH:4][cH:5][cH:6]1

Participants

5

Reactant 3

HCID 702EthanolHCID 6395Methanesulfonic AcidHCID 22311391N-(2-(Pyridin-3-ylmethyl)quinuclidin-3-yl)benzofuran-2-carboxamide

Product 2

HCID 6395Methanesulfonic AcidHCID 22311391N-(2-(Pyridin-3-ylmethyl)quinuclidin-3-yl)benzofuran-2-carboxamide

Sources & evidence

ORD record
ord-f108d3015aa5488caa2d48f17161448a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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