Chloride → Ethyl 4-(3,4-dimethoxyphenyl)-4-oxo-2-butenoate

HRID 194795Notes

Reaction equation

HRID 194795 reaction equation
[Al+3:18].[CH3:21][O:22][c:23]1[cH:24][cH:25][cH:26][cH:27][c:28]1[O:29][CH3:30].[Cl-:17].[Cl-:19].[Cl-:20].[Cl:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[ClH:31].[O:1]=[C:2]1[O:3][C:4](=[O:5])[CH:6]=[CH:7]1.[S:8]([O:9][CH2:10][CH3:11])([O:14][CH2:12][CH3:13])(=[O:15])=[O:16]>>[O:1]=[C:2]([CH:7]=[CH:6][C:4]([O:3][CH2:12][CH3:13])=[O:5])[c:25]1[cH:24][c:23]([O:22][CH3:21])[c:28]([O:29][CH3:30])[cH:27][cH:26]1

Participants

8

Reactant 7

HCID 312Chloride3×HCID 313Hydrochloric AcidHCID 6163Diethyl SulfateHCID 7043VeratroleHCID 7923Maleic AnhydrideHCID 7964ChlorobenzeneHCID 104727Aluminum Cation

Product 1

HCID 53400457Ethyl 4-(3,4-dimethoxyphenyl)-4-oxo-2-butenoate

Sources & evidence

ORD record
ord-65f37f300dcc4eaf8395ae56a320c3e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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