Bicarbonate Ion → Styrene Oxide

HRID 305903

Reaction equation

HRID 305903 reaction equation
[C:25](=[O:26])([OH:27])[O-:28].[CH2:1]=[CH:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[CH3:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20].[Mn+2:38].[NH2:21][C:22]([NH2:23])=[O:24].[Na+:29].[OH2:32].[OH:30][OH:31].[S:33]([O-:34])([O-:35])(=[O:36])=[O:37]>>[CH2:1]1[CH:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[O:24]1

Participants

10

Reactant 9

HCID 769Bicarbonate IonHCID 784Hydrogen PeroxideHCID 923Sodium ionHCID 962WaterHCID 1117Sulfate IonHCID 1176UreaHCID 7501StyreneHCID 8182DodecaneHCID 27854Manganese(2+)

Product 1

HCID 7276Styrene Oxide

Sources & evidence

ORD record
ord-735798967d954c46ae3ca130303a16aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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