Acetate → HCID 59026768, compound

HRID 160122Notes

Reaction equation

HRID 160122 reaction equation
[CH3:1][O:2][C:3]([c:4]1[c:5]([Br:18])[cH:6][n:7][cH:8][c:9]1[NH:10][c:11]1[c:12]([F:17])[cH:13][cH:14][cH:15][cH:16]1)=[O:19].[CH3:43][CH2:44][O:45][C:46]([CH3:47])=[O:48].[F:20][c:21]1[c:22]([B:27]([OH:28])[OH:29])[cH:23][cH:24][cH:25][cH:26]1.[K+:30].[K+:31].[O-:32][C:33]([O-:34])=[O:35].[O-:50][C:51]([CH3:52])=[O:53].[O-:54][C:55]([CH3:56])=[O:57].[O:36]1[CH2:37][CH2:38][O:39][CH2:40][CH2:41]1.[OH2:42].[Pd+2:49]>>[CH3:1][O:2][C:3]([c:4]1[c:5](-[c:22]2[c:21]([F:20])[cH:26][cH:25][cH:24][cH:23]2)[cH:6][n:7][cH:8][c:9]1[NH:10][c:11]1[c:12]([F:17])[cH:13][cH:14][cH:15][cH:16]1)=[O:19]

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 962WaterHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343542-Fluorophenylboronic acidHCID 59026790HCID 59026790, compound

Product 1

HCID 59026768HCID 59026768, compound

Sources & evidence

ORD record
ord-b048f4a75f164aa4a97d5b412501971b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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