Acetate → HCID 57531261, compound

HRID 678730Notes

Reaction equation

HRID 678730 reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:8]([C:9](=[O:10])[c:11]2[cH:12][c:13]([CH3:19])[c:14]([O:17][CH3:18])[cH:15][cH:16]2)=[O:20])[cH:5][cH:6][cH:7]1.[O-:60][C:61]([CH3:62])=[O:63].[O-:64][C:65]([CH3:66])=[O:67].[O:53]1[CH2:54][CH2:55][O:56][CH2:57][CH2:58]1.[OH2:52].[Pd+2:59].[c:21]1([CH3:22])[cH:23][cH:24][cH:25][cH:26][c:27]1[P:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][c:34]1[CH3:35])[c:36]1[cH:37][cH:38][cH:39][cH:40][c:41]1[CH3:42].[n:43]1[cH:44][cH:45][c:46]([B:49]([OH:50])[OH:51])[cH:47][cH:48]1>>[c:2]1(-[c:46]2[cH:45][cH:44][n:43][cH:48][cH:47]2)[cH:3][c:4]([C:8]([C:9](=[O:10])[c:11]2[cH:12][c:13]([CH3:19])[c:14]([O:17][CH3:18])[cH:15][cH:16]2)=[O:20])[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 962WaterHCID 312751,4-DioxaneHCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2734379(Pyridin-4-yl)boronic acidHCID 57531323HCID 57531323, compound

Product 1

HCID 57531261HCID 57531261, compound

Sources & evidence

ORD record
ord-9c9218a19d944a7fa6b3ff22112d8e8c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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