Formaldehyde → Methyl 2-(4-ethyl-3,5-dimethoxy-phenyl)-acrylate

HRID 202200Notes

Reaction equation

HRID 202200 reaction equation
[C:20]([O:21][CH3:22])(=[O:23])[C:24]([O:25][CH3:26])=[O:27].[C:53](=[O:54])([O-:55])[O-:56].[CH2:1]([c:2]1[c:3]([O:4][CH3:5])[cH:6][c:7]([CH2:8][C:9]([O:10][CH3:11])=[O:12])[cH:13][c:14]1[O:15][CH3:16])[CH3:17].[CH2:28]([CH3:29])[c:30]1[c:31]([O:49][CH3:50])[cH:32][c:33]([CH:38]([C:39](=[O:40])[O:41][CH3:42])[C:43](=[O:44])[C:45]([O:46][CH3:47])=[O:48])[cH:34][c:35]1[O:36][CH3:37].[CH2:51]=[O:52].[CH3:59][c:60]1[cH:61][cH:62][cH:63][cH:64][cH:65]1.[H-:19].[K+:57].[K+:58].[Na+:18].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[OH2:71]>>[CH2:28]([CH3:29])[c:30]1[c:31]([O:49][CH3:50])[cH:32][c:33]([C:38]([C:39](=[O:40])[O:41][CH3:42])=[CH2:43])[cH:34][c:35]1[O:36][CH3:37]

Participants

12

Reactant 11

HCID 712FormaldehydeHCID 813Potassium Cation2×HCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 8028TetrahydrofuranHCID 11120Dimethyl oxalateHCID 19660Carbonate IonHCID 166653HydrideHCID 18361969Dimethyl 2-(4-ethyl-3,5-dimethoxy-phenyl)-3-oxo-succinateHCID 54413910Methyl (4-ethyl-3,5-dimethoxy-phenyl)-acetate

Product 1

HCID 18361939Methyl 2-(4-ethyl-3,5-dimethoxy-phenyl)-acrylate

Sources & evidence

ORD record
ord-8ab0527f1e7244ac812037dc6742fe39
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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