Vitas-M small molecule compound

1-(1-methyl-4-nitro-1H-pyrazol-5-yl)ethanone

Catalog ID
STK349465
SMILES [O-][N+](=O)c1cnn(c1C(=O)C)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 C6H7N3O3 MW 169.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H7N3O3/c1-4(10)6-5(9(11)12)3-7-8(6)2/h3H,1-2H3
InChIKey
IEPWZWOJPQMRHI-UHFFFAOYSA-N
Synonyms
1006437-81-5
(O)(N+)(=O)c1cnn(c1C(=O)C)C
1(1methyl4nitro1Hpyrazol5yl)ethanone
1(2methyl4nitropyrazol3yl)ethanone
1006437815
5ACETYL1METHYL4NITROPYRAZOLE
CC(=O)C1=C(C=NN1C)(N+)(=O)(O)
InChI=1SC6H7N3O3c14(10)65(9(11)12)378(6)2h3H12H3
MFCD04968843
ZINC000002536686
ZINC02536686
ZINC2536686

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Available files

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