Water → (1RS,3RS,4RS,5SR,6RS)ethyl 3,4-epoxy-6-fluoro-2-oxobicyclo[3.1.0]hexane-6-carboxylate

HRID 1140775

Reaction equation

[C:21]([CH3:24])([O:25][O:22][OH:23])([CH3:26])[CH3:27].[CH3:14][c:15]1[cH:16][cH:17][cH:18][cH:19][cH:20]1.[F:1][C:2]1([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH:3]2[CH:4]=[CH:5][C:6](=[O:8])[CH:7]12.[OH2:28]>>[F:1][C:2]1([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH:3]2[CH:4]3[CH:5]([C:6](=[O:8])[CH:7]12)[O:25]3

Participants

Reactant 4

HCID 962Water

HCID 1140Toluene

HCID 11116005t-Butylhydroxyperoxide

HCID 69853125(1RS,5RS,6RS)ethyl 6-fluoro-2-oxobicyclo[3.1.0]hex-3-en-6-carboxylate

Product 1

HCID 85238918(1RS,3RS,4RS,5SR,6RS)ethyl 3,4-epoxy-6-fluoro-2-oxobicyclo[3.1.0]hexane-6-carboxylate

Sources & evidence

ORD record: ord-f9dba6a93eaf4e8f864cba5a286569c3
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Linked notes

Loading…