Potassium Cation → 1-[(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl]-3-nitropyrazole

HRID 2159394Notes

Reaction equation

HRID 2159394 reaction equation
[C:28](=[O:29])([O-:30])[O-:31].[CH3:34][N:35]([CH3:36])[CH:37]=[O:38].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:9][C:10]1([CH3:27])[O:11][CH2:12][CH:13]([CH2:15][O:16][S:17]([c:18]2[cH:19][cH:20][c:21]([CH3:22])[cH:23][cH:24]2)(=[O:25])=[O:26])[O:14]1.[K+:32].[K+:33].[N+:1](=[O:2])([O-:3])[c:4]1[n:5][nH:6][cH:7][cH:8]1>>[N+:1](=[O:2])([O-:3])[c:4]1[n:5][n:6]([CH2:15][CH:13]2[CH2:12][O:11][C:10]([CH3:9])([CH3:27])[O:14]2)[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 2350972,2-Dimethyl-1,3-dioxolan-4-ylmethyl p-toluenesulfonateHCID 178526745HCID 178526745, compound

Product 1

HCID 579191711-[(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl]-3-nitropyrazole

Sources & evidence

ORD record
ord-4bfbad5713ac4bb68421dba12a172d33
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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