Sodium ion → Ethyl 3-(2-isobutoxyphenyl)-2-propenoate

HRID 281160Notes

Reaction equation

HRID 281160 reaction equation
[CH2:17]([CH:18]([CH3:19])[CH3:20])[O:21][c:22]1[c:23]([CH:24]=[O:25])[cH:26][cH:27][cH:28][cH:29]1.[CH2:3]([O:4][P:5]([O:6][CH2:7][CH3:8])(=[O:9])[CH2:11][C:12](=[O:13])[O:14][CH2:15][CH3:16])[CH3:10].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[H-:1].[Na+:2].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH2:41]>>[CH:11]([C:12](=[O:13])[O:14][CH2:15][CH3:16])=[CH:24][c:23]1[c:22]([O:21][CH2:17][CH:18]([CH3:19])[CH3:20])[cH:29][cH:28][cH:27][cH:26]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 13345Triethyl phosphonoacetateHCID 166653HydrideHCID 38575282-(2-Methylpropoxy)benzaldehyde

Product 1

HCID 68983960Ethyl 3-(2-isobutoxyphenyl)-2-propenoate

Sources & evidence

ORD record
ord-5bc9f4a366b4483bba2ba736be915651
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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