Ethanol → 3-(3,5-Dimethoxy-phenyl)-3-(3-hydroxy-phenyl)-acrylonitrile

Reaction equation

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

Participants

Reactant 5

HCID 702Ethanol

HCID 961Hydroxide2×

HCID 8079Cyclohexene

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

HCID 692025963-(3-Benzyloxyphenyl)-3-(3,5-dimethoxyphenyl)acrylonitrile

Product 1

HCID 692024963-(3,5-Dimethoxy-phenyl)-3-(3-hydroxy-phenyl)-acrylonitrile

Sources & evidence

ORD record: ord-63d6388618c94245a84ae50bcf3f6261
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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