Acetate → (E)-Ethyl 3-(6-chloropyridin-3-YL)acrylate

HRID 683707Notes

Reaction equation

HRID 683707 reaction equation
[C:40]([CH:41]=[CH2:42])(=[O:43])[O:44][CH2:45][CH3:46].[CH3:52][CH2:53][CH2:54][CH2:55][CH2:56][CH3:57].[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[Cl:1][c:2]1[n:3][cH:4][c:5]([I:8])[cH:6][cH:7]1.[O-:65][C:66]([CH3:67])=[O:68].[O-:69][C:70]([CH3:71])=[O:72].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:73].[Pd+2:64].[c:9]1([CH3:10])[cH:11][cH:12][cH:13][cH:14][c:15]1[P:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][c:22]1[CH3:23])[c:24]1[cH:25][cH:26][cH:27][cH:28][c:29]1[CH3:30]>>[Cl:1][c:2]1[n:3][cH:4][c:5]([CH:42]=[CH:41][C:40](=[O:43])[O:44][CH2:45][CH3:46])[cH:6][cH:7]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 962WaterHCID 6228DimethylformamideHCID 8058HexaneHCID 8821Ethyl AcrylateHCID 8857Ethyl AcetateHCID 80271Tri-o-tolylphosphineHCID 81531DiisopropylethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 43971762-Chloro-5-iodopyridine

Product 1

HCID 53406713(E)-Ethyl 3-(6-chloropyridin-3-YL)acrylate

Sources & evidence

ORD record
ord-14069730aa0a4235a5ce1e7938c09f46
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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