Acetate → Ethyl 2-(2'-fluoro-2,4'-bipyridin-5-yl)acetate

HRID 1142440Notes

Reaction equation

HRID 1142440 reaction equation
[CH3:32][CH:33]([OH:34])[CH2:35][CH3:36].[CH3:37][CH2:38][O:39][C:40](=[O:41])[CH3:42].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:6][n:7]1.[F:14][c:15]1[n:16][cH:17][cH:18][c:19]([B:21]([OH:22])[OH:23])[cH:20]1.[K+:29].[K+:30].[K+:31].[O-:44][C:45]([CH3:46])=[O:47].[O-:48][C:49]([CH3:50])=[O:51].[P:24]([O-:25])([O-:26])([O-:27])=[O:28].[Pd+2:43]>>[c:2]1(-[c:19]2[cH:18][cH:17][n:16][c:15]([F:14])[cH:20]2)[cH:3][cH:4][c:5]([CH2:8][C:9](=[O:10])[O:11][CH2:12][CH3:13])[cH:6][n:7]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 1061PhosphateHCID 6568(+-)-2-ButanolHCID 8857Ethyl AcetateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27833962-Fluoropyridine-4-boronic acidHCID 15661146Ethyl 2-(6-chloropyridin-3-yl)acetate

Product 1

HCID 58447698Ethyl 2-(2'-fluoro-2,4'-bipyridin-5-yl)acetate

Sources & evidence

ORD record
ord-22b4aafb2a574f0b9db2f9f4d5c6b788
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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