ChemicalBook--->CAS DataBase List--->38858-90-1

38858-90-1

38858-90-1 Structure

38858-90-1 Structure
IdentificationBack Directory
[Name]

4-Methyl-3-nitropyrazole
[CAS]

38858-90-1
[Synonyms]

4-Methyl-3-nitropyrazole
4-Methyl-5-nitro-pyrazole
4-Methyl-3-nitro-1H-pyrazole
4-methyl-3-nitro-2H-pyrazole
1H-Pyrazole, 4-methyl-3-nitro-
[Molecular Formula]

C4H5N3O2
[MDL Number]

MFCD08685901
[MOL File]

38858-90-1.mol
[Molecular Weight]

127.101
Chemical PropertiesBack Directory
[Boiling point ]

317.2±22.0 °C(Predicted)
[density ]

1.426±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

crystalline solid
[pka]

9.27±0.50(Predicted)
[color ]

Off white to faint beige
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933199090
Hazard InformationBack Directory
[Uses]

4-Methyl-3-nitropyrazole is used in the synthesis of 4-(N-azolyl)-3,5-dinitropyrazoles.
[Synthesis]

5-Iodo-4-methyl-1H-pyrazole

24086-18-8

4-Methyl-3-nitropyrazole

38858-90-1

General method: 5-iodo-4-methyl-1H-pyrazole (1 mmol) was dissolved in tetrahydrofuran (THF, 10 mL) and Fuajasite catalyst (250 mg) was added. Concentrated nitric acid (density 1.52 g/cm3, 10 mL) was added slowly and the reaction mixture was stirred at room temperature until the reaction was complete. Upon completion of the reaction, the catalyst was recovered by filtration and the filtrate was extracted with dichloromethane several times. The organic phases were combined and concentrated under reduced pressure to remove the solvent to give the target product 4-methyl-3-nitro-1H-pyrazole.

[References]

[1] Synthetic Communications, 2012, vol. 42, # 23, p. 3463 - 3471
[2] Catalysis Communications, 2013, vol. 42, p. 35 - 39
Spectrum DetailBack Directory
[Spectrum Detail]

4-Methyl-3-nitropyrazole(38858-90-1)1HNMR
4-Methyl-3-nitropyrazole(38858-90-1)FT-IR
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