Acetate → HCID 68962150, compound

HRID 206601Notes

Reaction equation

HRID 206601 reaction equation
[Br:1][c:2]1[cH:3][s:4][cH:5][cH:6]1.[C:49]([O-:50])(=[O:51])[CH3:52].[C:54]([O-:55])(=[O:56])[CH3:57].[C:7](=[O:8])([O-:9])[O-:10].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[CH3:64][N:65]([CH3:66])[C:67](=[O:68])[CH3:69].[Cs+:11].[Cs+:12].[F:13][c:14]1[cH:15][cH:16][c:17]([NH:18][c:19]2[c:20]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[cH:28][cH:29][c:30]([CH:32]=[CH2:33])[cH:31]2)[cH:34][cH:35]1.[OH:36][C:37]([CH2:38][C:39]([C:40](=[O:41])[OH:42])([CH2:43][C:44](=[O:45])[OH:46])[OH:47])=[O:48].[Pd+2:53]>>[c:2]1([CH:33]=[CH:32][c:30]2[cH:29][cH:28][c:20]([C:21](=[O:22])[O:23][C:24]([CH3:25])([CH3:26])[CH3:27])[c:19]([NH:18][c:17]3[cH:16][cH:15][c:14]([F:13])[cH:35][cH:34]3)[cH:31]2)[cH:3][s:4][cH:5][cH:6]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 311Citric AcidHCID 8857Ethyl AcetateHCID 133833-BromothiopheneHCID 19660Carbonate IonHCID 31374DimethylacetamideHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 68959213Tert-butyl 2-(4-fluoroanilino)-4-vinylbenzoate

Product 1

HCID 68962150HCID 68962150, compound

Sources & evidence

ORD record
ord-fb891e8866434bca8ab672fbf1119576
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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