Vitas-M small molecule compound

1-(3,5-diamino-4-nitro-1H-pyrazol-1-yl)ethanone

Catalog ID
STL298244
SMILES [O-][N+](=O)c1c(N)nn(c1N)C(=O)C

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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 C5H7N5O3 MW 185.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H7N5O3/c1-2(11)9-5(7)3(10(12)13)4(6)8-9/h7H2,1H3,(H2,6,8)
InChIKey
DKXWQNGGAKKGTF-UHFFFAOYSA-N
Synonyms
292600-38-5
(O)(N+)(=O)c1c(N)nn(c1N)C(=O)C
1(35diamino4nitro1Hpyrazol1yl)ethanone
1(35DIAMINO4NITROPYRAZOL1YL)ETHANONE
1ACETYL35DIAMINO4NITRO1HPYRAZOLE
1ACETYL4NITRO1HPYRAZOLE35DIAMINE
292600385
CC(=O)N1C(=C(C(=N1)N)(N+)(=O)(O))N
InChI=1SC5H7N5O3c12(11)95(7)3(10(12)13)4(6)89h7H21H3(H268)
MFCD01559101
ZINC000004170698
ZINC04170698
ZINC4170698

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Available files

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