Acetate → 3-(4-Fluoro-2-methyl-phenyl)-acrylic acid ethyl ester

HRID 141315

Reaction equation

HRID 141315 reaction equation
[Br:1][c:2]1[c:3]([CH3:9])[cH:4][c:5]([F:8])[cH:6][cH:7]1.[C:41]([CH:42]=[CH2:43])(=[O:44])[O:45][CH2:46][CH3:47].[C:48](#[N:49])[CH2:50][CH3:51].[C:52]([O-:53])(=[O:54])[CH3:55].[C:57]([O-:58])(=[O:59])[CH3:60].[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[Pd+2:56].[c:10]1([CH3:11])[cH:12][cH:13][cH:14][cH:15][c:16]1[P:17]([c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1[CH3:24])[c:25]1[cH:26][cH:27][cH:28][cH:29][c:30]1[CH3:31]>>[c:2]1([CH:43]=[CH:42][C:41](=[O:44])[O:45][CH2:46][CH3:47])[c:3]([CH3:9])[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 7854PropionitrileHCID 8821Ethyl AcrylateHCID 80271Tri-o-tolylphosphineHCID 81531DiisopropylethylamineHCID 967432-Bromo-5-fluorotolueneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

HCID 537177243-(4-Fluoro-2-methyl-phenyl)-acrylic acid ethyl ester

Sources & evidence

ORD record
ord-a618fd15442d4bf9affd5e261ba0fb64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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