Sodium ion → 2-(2-Phenylpropyl)-2-trifluoromethyl-oxiran

HRID 699798Notes

Reaction equation

HRID 699798 reaction equation
[CH3:30][N:31]([CH3:32])[CH:33]=[O:34].[H-:28].[Na+:29].[OH2:35].[OH:1][C:2]([CH2:3][O:4][S:5]([c:6]1[cH:7][cH:8][c:9]([CH3:10])[cH:11][cH:12]1)(=[O:13])=[O:14])([CH2:15][CH:16]([CH3:17])[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1)[C:24]([F:25])([F:26])[F:27]>>[C:2]1([CH2:15][CH:16]([CH3:17])[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)([C:24]([F:25])([F:26])[F:27])[CH2:3][O:4]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 962WaterHCID 6228DimethylformamideHCID 166653HydrideHCID 185511734-Toluenesulfonic acid-(2-hydroxy-4-phenyl-2-trifluoromethyl-pentyl)-ester

Product 1

HCID 185512062-(2-Phenylpropyl)-2-trifluoromethyl-oxiran

Sources & evidence

ORD record
ord-6a4c49d70d174f51858d30f9248b60f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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