4-Nitropyrazole , 97% , 2075-46-9

CAS NO.：2075-46-9

Empirical Formula: C3H3N3O2

Molecular Weight: 113.07

MDL number: MFCD00159626

EINECS: 212-146-4

PRODUCT Properties

• Melting point: 160-164°C
• Boiling point: 323°C(lit.)
• Density: 1.552±0.06 g/cm3(Predicted)
• storage temp.: Keep in dark place,Sealed in dry,Room Temperature
• pka: 9.63±0.50(Predicted)
• form: Crystalline Powder
• color: White
• λmax: 317nm(EtOH)(lit.)
• InChI: InChI=1S/C3H3N3O2/c7-6(8)3-1-4-5-2-3/h1-2H,(H,4,5)
• InChIKey: XORHNJQEWQGXCN-UHFFFAOYSA-N
• SMILES: N1C=C([N+]([O-])=O)C=N1
• CAS DataBase Reference: 2075-46-9(CAS DataBase Reference)
• NIST Chemistry Reference: 4-NO2-pyrazole(2075-46-9)

Description and Uses

4-Nitropyrazole is a kind of low detonation velocity and high detonation pressure explosive, which has a promising future in the field of energetic materials. 4-Nitropyrazole is also used as raw material to synthesize 4-amino-3,5-dinitropyrazole, a useful intermediate for preparing trinitropyrazole. Currently, 4-nitro pyrazole is prepared by reacting with nitric acid, sulfuric acid, or nitric acid-trifluoroacetic anhydride mixtures. The reaction product contains a small amount of isomers of 4-nitropyrazole and some unknown by-products. To extend the application of 4-nitropyrazole, the crude product must be isolated and purified[1].

4-Nitropyrazole, is a building block for the synthesis of various pharmaceutical compounds, including inhibitors, and therapeutic agents. It can be used for the synthesis of highly selective, brain-penetrant aminopyrazole LRRK2 Inhibitor, as a potentially viable treatment for Parkinson''s disease.

Safety

• Symbol(GHS): GHS05,GHS07
• Signal word: Danger
• Hazard statements: H302-H318
• Precautionary statements: P264-P270-P280-P301+P312-P305+P351+P338-P501
• Hazard Codes: Xi,Xn
• Risk Statements: 22-41
• Safety Statements: 26-39
• RTECS: UQ7880000
• HazardClass: IRRITANT
• HS Code: 29331990