Acetate → HCID 57932899, compound

HRID 2151771Notes

Reaction equation

HRID 2151771 reaction equation
[Br:12][c:13]1[c:14]([Cl:24])[cH:15][c:16](-[c:18]2[n:19][cH:20][n:21][n:22]2[CH3:23])[s:17]1.[C:25](=[O:26])([O-:27])[O-:28].[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:10])[cH:8][cH:9]2)[cH:11]1.[Cl:52][CH2:53][Cl:54].[Cs+:29].[Cs+:30].[N:31]#[N:32].[O-:56][C:57]([CH3:58])=[O:59].[O-:60][C:61]([CH3:62])=[O:63].[O:64]=[CH:65][N:66]([CH3:67])[CH3:68].[Pd+2:55].[c:33]1([P:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:10])[cH:8][cH:9]2)[c:11]1-[c:13]1[c:14]([Cl:24])[cH:15][c:16](-[c:18]2[n:19][cH:20][n:21][n:22]2[CH3:23])[s:17]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 947NitrogenHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 218176672,6-Dimethylimidazo[1,2-b]pyridazineHCID 667214755-(5-Bromo-4-chloro-thiophen-2-yl)-1-methyl-[1,2,4]triazole

Product 1

HCID 57932899HCID 57932899, compound

Sources & evidence

ORD record
ord-33211cf8baec4319bc8fd73862ed4cbf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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