Acetate → 1-Methyl-4-(5-vinylpyridin-2-yl)piperazine

HRID 2326649Notes

Reaction equation

HRID 2326649 reaction equation
[Br:3][CH2:4][CH2:5][Br:6].[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH3:26][N:27]1[CH2:28][CH2:29][N:30]([c:33]2[n:34][cH:35][c:36]([B:39]3[O:40][C:41]([CH3:42])([CH3:43])[C:44]([CH3:45])([CH3:46])[O:47]3)[cH:37][cH:38]2)[CH2:31][CH2:32]1.[K+:2].[O-:54][C:55]([CH3:56])=[O:57].[O-:58][C:59]([CH3:60])=[O:61].[OH-:1].[Pd+2:53].[c:7]1([P:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[cH:21][cH:22][cH:23][cH:24][cH:25]1>>[CH:4](=[CH2:5])[c:36]1[cH:35][n:34][c:33]([N:30]2[CH2:29][CH2:28][N:27]([CH3:26])[CH2:32][CH2:31]2)[cH:38][cH:37]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 813Potassium CationHCID 961HydroxideHCID 78391,2-DibromoethaneHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27696181-Methyl-4-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine

Product 1

HCID 667303221-Methyl-4-(5-vinylpyridin-2-yl)piperazine

Sources & evidence

ORD record
ord-731b83fc635144228b8975d008f35dd7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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