Acetate → Ethyl 3-quinolineacrylate

HRID 300215Notes

Reaction equation

HRID 300215 reaction equation
[Br-:29].[Br:1][c:2]1[cH:3][n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[cH:11]1.[C:12]([CH:13]=[CH2:14])(=[O:15])[O:16][CH2:17][CH3:18].[C:19](=[O:20])([OH:21])[O-:22].[CH3:30][CH2:31][CH2:32][CH2:33][N+:34]([CH2:35][CH2:36][CH2:37][CH3:38])([CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH2:45][CH3:46].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Na+:23].[O-:48][C:49]([CH3:50])=[O:51].[O-:52][C:53]([CH3:54])=[O:55].[O:24]=[CH:25][N:26]([CH3:27])[CH3:28].[Pd+2:47]>>[c:2]1([CH:14]=[CH:13][C:12](=[O:15])[O:16][CH2:17][CH3:18])[cH:3][n:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]2[cH:11]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 259Bromide ionHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 8821Ethyl AcrylateHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 214133-BromoquinolineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

HCID 53657281Ethyl 3-quinolineacrylate

Sources & evidence

ORD record
ord-2d3656d4c667493f8e6c55ad1fb17e8d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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