Acetate → HCID 86653033, compound

HRID 1234740Notes

Reaction equation

HRID 1234740 reaction equation
[Cl:1][c:2]1[n:3][c:4]2[c:5]([CH3:14])[cH:6][cH:7][cH:8][c:9]2[cH:10][c:11]1[CH:12]=[O:13].[K+:23].[K+:24].[O-:25][C:26]([O-:27])=[O:28].[O-:50][C:51]([CH3:52])=[O:53].[O-:54][C:55]([CH3:56])=[O:57].[OH2:48].[Pd+2:49].[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1.[s:15]1[c:16]([B:20]([OH:21])[OH:22])[cH:17][cH:18][cH:19]1>>[c:2]1(-[c:16]2[s:15][cH:19][cH:18][cH:17]2)[n:3][c:4]2[c:5]([CH3:14])[cH:6][cH:7][cH:8][c:9]2[cH:10][c:11]1[CH:12]=[O:13]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 962WaterHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 6890822-Chloro-8-methylquinoline-3-carboxaldehydeHCID 27339602-Thiopheneboronic acid

Product 1

HCID 86653033HCID 86653033, compound

Sources & evidence

ORD record
ord-6887a4a7f6384639b902799688837d93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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