Acetate → Tert-butyl 3-[4-[cyclohexylidene-(4-hydroxyphenyl)methyl]phenyl]prop-2-enoate

HRID 1127408Notes

Reaction equation

HRID 1127408 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:6][cH:7]1.[C:22]([CH:23]=[CH2:24])(=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30].[CH3:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37].[CH3:38][C:39](=[O:40])[O-:41].[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[CH3:58][C:59]#[N:60].[O-:43][C:44]([CH3:45])=[O:46].[O-:47][C:48]([CH3:49])=[O:50].[OH2:51].[Pd+2:42]>>[c:2]1([CH:24]=[CH:23][C:22](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:3][cH:4][c:5]([C:8]([c:9]2[cH:10][cH:11][c:12]([OH:15])[cH:13][cH:14]2)=[C:16]2[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 175Acetate3×HCID 962WaterHCID 6342AcetonitrileHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 15458tert-Butyl acrylateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 686545334-[(4-Bromophenyl)(cyclohexylidene)methyl]phenol

Product 1

HCID 68977712Tert-butyl 3-[4-[cyclohexylidene-(4-hydroxyphenyl)methyl]phenyl]prop-2-enoate

Sources & evidence

ORD record
ord-c3561e61058e4c17bb8adfae732d9111
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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