Acetate → HCID 57932923, compound

HRID 1118819Notes

Reaction equation

HRID 1118819 reaction equation
[Br:19][c:20]1[c:21]([Cl:31])[cH:22][c:23](-[c:25]2[n:26][cH:27][n:28][n:29]2[CH3:30])[s:24]1.[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:17])[cH:8][c:9]2[CH:10]([CH2:11][CH2:12][CH3:13])[CH2:14][CH2:15][CH3:16])[cH:18]1.[CH3:39][CH2:40][O:41][C:42]([CH3:43])=[O:44].[CH3:54][N:55]1[CH2:56][CH2:57][CH2:58][C:59]1=[O:60].[K+:36].[N:37]#[N:38].[O-:32][C:33]([CH3:34])=[O:35].[O-:46][C:47]([CH3:48])=[O:49].[O-:50][C:51]([CH3:52])=[O:53].[Pd+2:45]>>[CH3:1][c:2]1[n:3][c:4]2[n:5]([n:6][c:7]([CH3:17])[cH:8][c:9]2[CH:10]([CH2:11][CH2:12][CH3:13])[CH2:14][CH2:15][CH3:16])[c:18]1-[c:20]1[c:21]([Cl:31])[cH:22][c:23](-[c:25]2[n:26][cH:27][n:28][n:29]2[CH3:30])[s:24]1

Participants

9

Reactant 8

HCID 175Acetate3×HCID 813Potassium CationHCID 947NitrogenHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 667214755-(5-Bromo-4-chloro-thiophen-2-yl)-1-methyl-[1,2,4]triazoleHCID 688409972,6-Dimethyl-8-(1-propyl-butyl)-imidazo[1,2-b]pyridazine

Product 1

HCID 57932923HCID 57932923, compound

Sources & evidence

ORD record
ord-51e82c7e8da94b97a17c491c474fb3ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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