Acetone → 2-[5-(4-Chloro-phenyl)-2-ethyl-thiophen-3-yl]-cyclopent-4-ene-1,3-dione

HRID 306268Notes

Reaction equation

HRID 306268 reaction equation
[CH3:22][C:23](=[O:24])[CH3:25].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH:15]3[CH:16]([OH:21])[CH:17]=[CH:18][C:19]3=[O:20])[c:11]([CH2:13][CH3:14])[s:12]2)[cH:6][cH:7]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH:15]3[C:16](=[O:21])[CH:17]=[CH:18][C:19]3=[O:20])[c:11]([CH2:13][CH3:14])[s:12]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 180AcetoneHCID 595846365-[5-(4-Chloro-phenyl)-2-ethyl-thiophen-3-yl]-4-hydroxy-cyclopent-2-enone

Product 1

HCID 595845932-[5-(4-Chloro-phenyl)-2-ethyl-thiophen-3-yl]-cyclopent-4-ene-1,3-dione

Sources & evidence

ORD record
ord-faa827a4e1fb4fdbb51ef70cb87198fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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