Dimethyl Sulfoxide → 4-nitro-1-phenyl-1H-pyrazole

HRID 289310Notes

Reaction equation

HRID 289310 reaction equation
[CH3:33][S:34]([CH3:35])=[O:36].[Cu:37][I:38].[I:9][c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1.[K+:27].[K+:28].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][n:6][nH:7][cH:8]1.[O-:29][C:30]([O-:31])=[O:32].[OH2:39].[OH:16][c:17]1[cH:18][cH:19][cH:20][c:21]2[c:22]1[n:23][cH:24][cH:25][cH:26]2>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][n:6][n:7](-[c:10]2[cH:11][cH:12][cH:13][cH:14][cH:15]2)[cH:8]1

Participants

9

Reactant 8

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 19238-HydroxyquinolineHCID 11575IodobenzeneHCID 163764-nitro-1H-pyrazoleHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

Product 1

HCID 27558944-nitro-1-phenyl-1H-pyrazole

Sources & evidence

ORD record
ord-0fa9aa9a637a4481b3b5f3f3858edb3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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