ChemicalBook--->CAS DataBase List--->400755-41-1

400755-41-1

400755-41-1 Structure

400755-41-1 Structure
IdentificationBack Directory
[Name]

1H-Pyrazole,3-methoxy-4-nitro-(9CI)
[CAS]

400755-41-1
[Synonyms]

3-Methoxy-4-nitropyrazole
1H-Pyrazole, 3-methoxy-4-nitro-
1H-Pyrazole,3-methoxy-4-nitro-(9CI)
[Molecular Formula]

C4H5N3O3
[MDL Number]

MFCD03419421
[MOL File]

400755-41-1.mol
[Molecular Weight]

143.1
Chemical PropertiesBack Directory
[Melting point ]

198-201 °C
[Boiling point ]

375.4±22.0 °C(Predicted)
[density ]

1.477
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

8.67±0.50(Predicted)
[InChI]

InChI=1S/C4H5N3O3/c1-10-4-3(7(8)9)2-5-6-4/h2H,1H3,(H,5,6)
[InChIKey]

GLNYWXCDHONDOZ-UHFFFAOYSA-N
[SMILES]

N1C=C([N+]([O-])=O)C(OC)=N1
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

3-Methoxy-4-nitro-1H-pyrazole is used as a reagent in the preparation of pyridine compounds which act as focal adhesion kinase inhibitors and therefore me be useful in treatment of diseases such as cancer in warm-blooded animals. 3-Methoxy-4-nitro-1H-pyrazole is also used as a reagent in the synthesis of purine derivatives which may act as inhibitors of mutant EGF receptors.
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Pyrazole,3-methoxy-4-nitro-(9CI)(400755-41-1)1HNMR
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