Acetate → Ethyl 3-(4-amino-2-fluorophenyl)prop-2-enoate

HRID 1138150Notes

Reaction equation

HRID 1138150 reaction equation
[Br:1][c:2]1[c:3]([F:9])[cH:4][c:5]([NH2:6])[cH:7][cH:8]1.[C:10]([CH:11]=[CH2:12])(=[O:13])[O:14][CH2:15][CH3:16].[CH3:17][c:18]1[cH:19][cH:20][cH:21][cH:22][c:23]1[P:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][c:30]1[CH3:31])[c:32]1[cH:33][cH:34][cH:35][cH:36][c:37]1[CH3:38].[CH3:57][N:58]([CH3:59])[CH:60]=[O:61].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[O-:49][C:50]([CH3:51])=[O:52].[O-:53][C:54]([CH3:55])=[O:56].[Pd+2:48]>>[c:2]1([CH:12]=[CH:11][C:10](=[O:13])[O:14][CH2:15][CH3:16])[c:3]([F:9])[cH:4][c:5]([NH2:6])[cH:7][cH:8]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 6228DimethylformamideHCID 8821Ethyl AcrylateHCID 80271Tri-o-tolylphosphineHCID 81531DiisopropylethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 8218484-Bromo-3-fluoroaniline

Product 1

HCID 53987187Ethyl 3-(4-amino-2-fluorophenyl)prop-2-enoate

Sources & evidence

ORD record
ord-9574fcebbc6e4ebb9ae72cbdaf0d163d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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