Ethanol → HCID 59692835, compound

HRID 171145Notes

Reaction equation

HRID 171145 reaction equation
[CH2:16]([CH3:17])[O:18][C:19](=[O:20])[CH:21]([C:22]([CH2:23][S+:24]([CH3:25])[CH3:26])([CH3:27])[c:28]1[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]1)[C:35](=[O:36])[O:37][CH2:38][CH3:39].[CH3:2][CH2:3][O-:4].[CH3:40][CH2:41][OH:42].[Na+:1].[c:5]1([CH3:6])[cH:7][cH:8][c:9]([S:10]([O-:11])(=[O:12])=[O:13])[cH:14][cH:15]1>>[CH2:16]([CH3:17])[O:18][C:19](=[O:20])[C:21]1([C:35](=[O:36])[O:37][CH2:38][CH3:39])[C:22]([CH3:27])([c:28]2[cH:29][cH:30][c:31]([F:34])[cH:32][cH:33]2)[CH2:23]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 85570p-ToluenesulfonateHCID 1194401-Hydroxyethyl radicalHCID 59692395HCID 59692395, compound

Product 1

HCID 59692835HCID 59692835, compound

Sources & evidence

ORD record
ord-c463520107cf4f77a131302e614a0a47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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