Citric Acid → Ethyl 3-(4-pyridyl)-3-oxopropionate

HRID 210559Notes

Reaction equation

HRID 210559 reaction equation
[C:10]([n:11]1[cH:12][cH:13][n:14][cH:15]1)([n:16]1[cH:17][cH:18][n:19][cH:20]1)=[O:21].[C:23]([CH2:24][C:25]([O-:26])=[O:27])(=[O:28])[O:29][CH2:30][CH3:31].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Mg+:22].[O:45]1[CH2:46][CH2:47][CH2:48][CH2:49]1.[OH2:50].[OH:32][C:33]([CH2:34][C:35]([C:36](=[O:37])[OH:38])([CH2:39][C:40](=[O:41])[OH:42])[OH:43])=[O:44].[n:1]1[cH:2][cH:3][c:4]([C:7](=[O:8])[OH:9])[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([C:7](=[O:9])[CH2:24][C:23](=[O:28])[O:29][CH2:30][CH3:31])[cH:5][cH:6]1

Participants

9

Reactant 8

HCID 311Citric AcidHCID 962WaterHCID 5922Isonicotinic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 682631,1'-CarbonyldiimidazoleHCID 3595298Propanedioic acid, monoethyl esterHCID 178506988HCID 178506988, compound

Product 1

HCID 2735202Ethyl 3-(4-pyridyl)-3-oxopropionate

Sources & evidence

ORD record
ord-302a343f01654ae580b96382fffa344b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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