Ethanol → 4'-[2-Ethoxy-4-ethyl-5-(hydroxyiminomethyl)imidazol-1-ylmethyl]-3'-fluorobiphenyl-2-carboxylic acid t-butyl ester

HRID 160984Notes

Reaction equation

HRID 160984 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[c:9](-[c:14]2[cH:15][c:16]([F:34])[c:17]([CH2:20][n:21]3[c:22]([O:31][CH2:32][CH3:33])[n:23][c:24]([CH:29]=[CH2:30])[c:25]3[CH:26]=[N:27][OH:28])[cH:18][cH:19]2)[cH:10][cH:11][cH:12][cH:13]1.[CH3:35][CH2:36][OH:37].[OH-:38].[OH-:40].[OH2:41].[Pd+2:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[c:9](-[c:14]2[cH:15][c:16]([F:34])[c:17]([CH2:20][n:21]3[c:22]([O:31][CH2:32][CH3:33])[n:23][c:24]([CH2:29][CH3:30])[c:25]3[CH:26]=[N:27][OH:28])[cH:18][cH:19]2)[cH:10][cH:11][cH:12][cH:13]1

Participants

6

Reactant 5

HCID 702EthanolHCID 961Hydroxide2×HCID 962WaterHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 722660174'-[2-Ethoxy-5-(hydroxyiminomethyl)-4-vinylimidazol-1-ylmethyl]-3'-fluorobiphenyl-2-carboxylic acid t-butyl ester

Product 1

HCID 725729554'-[2-Ethoxy-4-ethyl-5-(hydroxyiminomethyl)imidazol-1-ylmethyl]-3'-fluorobiphenyl-2-carboxylic acid t-butyl ester

Sources & evidence

ORD record
ord-e68ea1ccccfb482eaae1b9153ff8e81f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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