Acetate → HCID 86630682, compound

HRID 210695Notes

Reaction equation

HRID 210695 reaction equation
[Br:1][c:2]1[cH:3][n:4][n:5]2[c:6]1[n:7][c:8](-[c:17]1[cH:18][cH:19][c:20]([CH:21]=[O:22])[cH:23][cH:24]1)[c:9](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[cH:10]2.[C:48]([O-:49])(=[O:50])[CH3:51].[C:53]([O-:54])(=[O:55])[CH3:56].[CH3:25][B:26]([OH:27])[OH:28].[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Cl:45][CH2:46][Cl:47].[K+:34].[K+:35].[K+:36].[OH2:44].[P:29]([O-:30])([O-:31])([O-:32])=[O:33].[Pd+2:52]>>[c:2]1([CH3:25])[cH:3][n:4][n:5]2[c:6]1[n:7][c:8](-[c:17]1[cH:18][cH:19][c:20]([CH:21]=[O:22])[cH:23][cH:24]1)[c:9](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[cH:10]2

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 1140TolueneHCID 6344DichloromethaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 139377Methylboronic AcidHCID 86630675HCID 86630675, compound

Product 1

HCID 86630682HCID 86630682, compound

Sources & evidence

ORD record
ord-de38dd2c9a254063b7c5b467c78ed04d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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