Acetate → HCID 135592938, compound

HRID 1571206Notes

Reaction equation

HRID 1571206 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([n:7][o:8][n:9]2)[cH:10]1.[C:43](=[O:44])([O-:45])[O-:46].[CH3:49][N:50]([CH3:51])[CH:52]=[O:53].[K+:47].[K+:48].[O-:55][C:56]([CH3:57])=[O:58].[O-:59][C:60]([CH3:61])=[O:62].[OH2:63].[OH:11][c:12]1[c:13]([B:18]([OH:19])[OH:20])[cH:14][cH:15][cH:16][cH:17]1.[Pd+2:54].[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]>>[c:2]1(-[c:13]2[c:12]([OH:11])[cH:17][cH:16][cH:15][cH:14]2)[cH:3][cH:4][c:5]2[c:6]([n:7][o:8][n:9]2)[cH:10]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2773454(2-Hydroxyphenyl)boronic acidHCID 27762985-Bromo-2,1,3-benzoxadiazole

Product 1

HCID 135592938HCID 135592938, compound

Sources & evidence

ORD record
ord-a3a9d320a73147978d94112b93f7273f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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