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

HRID 695733Notes

Reaction equation

HRID 695733 reaction equation
[CH3:19][O:20][C:21]([CH3:22])([CH3:23])[O:24][CH3:25].[CH3:26][C:27](=[O:28])[CH3:29].[N+:1](=[O:2])([O-:3])[c:4]1[n:5][n:6]([CH2:9][CH:10]([CH2:11][OH:12])[OH:13])[cH:7][cH:8]1.[S:14](=[O:15])(=[O:16])([OH:17])[OH:18]>>[N+:1](=[O:2])([O-:3])[c:4]1[n:5][n:6]([CH2:9][CH:10]2[CH2:11][O:12][C:21]([CH3:22])([CH3:23])[O:13]2)[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 1118Sulfuric AcidHCID 64952,2-DimethoxypropaneHCID 579192323-(3-Nitropyrazol-1-yl)propane-1,2-diol

Product 1

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

Sources & evidence

ORD record
ord-1e11d8d3e197487ca1112696aa478d9a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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