Vitas-M small molecule compound

1-methyl-3-nitro-1H-pyrazole-5-carbonitrile

Catalog ID
STL414949
SMILES N#Cc1cc(nn1C)[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 C5H4N4O2 MW 152.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H4N4O2/c1-8-4(3-6)2-5(7-8)9(10)11/h2H,1H3
InChIKey
NROJKIMPBOEHMA-UHFFFAOYSA-N
Synonyms
1245771-75-8
1245771758
1methyl3nitro1Hpyrazole5carbonitrile
1METHYL3NITROPYRAZOLE5CARBONITRILE
2methyl5nitropyrazole3carbonitrile
CN1C(=CC(=N1)(N+)(=O)(O))C#N
InChI=1SC5H4N4O2c184(36)25(78)9(10)11h2H1H3
MFCD18374170
N#Cc1cc(nn1C)(N+)(=O)(O)
ZINC000072334131
ZINC72334131

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Available files

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