Vitas-M small molecule compound

5-methyl-4-nitro-2-phenyl-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK399891
SMILES [O-][N+](=O)c1c(C)[nH]n(c1=O)c1ccccc1

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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 C10H9N3O3 MW 219.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N3O3/c1-7-9(13(15)16)10(14)12(11-7)8-5-3-2-4-6-8/h2-6,11H,1H3
InChIKey
NMWHQZMIFHSGTN-UHFFFAOYSA-N
Synonyms
52944-72-6
(O)(N+)(=O)c1c(C)(nH)n(c1=O)c1ccccc1
3METHYL4NITRO1PHENYL3PYRAZOLIN5ONE
52944726
5methyl4nitro2phenyl12dihydro3Hpyrazol3one
5METHYL4NITRO2PHENYL12DIHYDROPYRAZOL3ONE
5METHYL4NITRO2PHENYL1HPYRAZOL3ONE
CC1=C(C(=O)N(N1)C2=CC=CC=C2)(N+)(=O)(O)
InChI=1SC10H9N3O3c179(13(15)16)10(14)12(117)8532468h2611H1H3
MFCD03722870
ZINC000100277881
ZINC100277881
ZINC15019319

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Available files

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