Vitas-M small molecule compound

3,4-dinitro-1H-pyrazole

Catalog ID
STK349887
SMILES [O-][N+](=O)c1n[nH]cc1[N+](=O)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C3H2N4O4 MW 158.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C3H2N4O4/c8-6(9)2-1-4-5-3(2)7(10)11/h1H,(H,4,5)
InChIKey
VXMCBBMNFIAYQD-UHFFFAOYSA-N
Synonyms
38858-92-3
(O)(N+)(=O)c1n(nH)cc1(N+)(=O)(O)
1HPYRAZOLE34DINITRO
34dinitro1Hpyrazole
34DINITROPYRAZOLE
38858923
45DINITRO1HPYRAZOLE
C1=NNC(=C1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC3H2N4O4c86(9)21453(2)7(10)11h1H(H45)
MFCD00159604
ZINC000005248441
ZINC05248441
ZINC5248441

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.