Ethanol → HCID 11359669, compound

HRID 1112797Notes

Reaction equation

HRID 1112797 reaction equation
[CH3:38][CH2:39][OH:40].[Na+:37].[OH-:36].[c:1]1([S:2](=[O:3])(=[O:4])[n:10]2[cH:11][c:12]([C:28]#[C:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[c:13]3[c:14]2[n:15][cH:16][c:17](-[c:19]2[cH:20][cH:21][c:22]([N:25]([CH3:26])[CH3:27])[cH:23][cH:24]2)[cH:18]3)[cH:5][cH:6][cH:7][cH:8][cH:9]1>>[nH:10]1[cH:11][c:12]([C:28]#[C:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:13]2[c:14]1[n:15][cH:16][c:17](-[c:19]1[cH:20][cH:21][c:22]([N:25]([CH3:26])[CH3:27])[cH:23][cH:24]1)[cH:18]2

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 86613122HCID 86613122, compound

Product 1

HCID 11359669HCID 11359669, compound

Sources & evidence

ORD record
ord-e39ee512467f42439c06558319daa305
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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