Vitas-M small molecule compound

(3-nitro-1H-pyrazol-1-yl)acetic acid

Catalog ID
STK315885
SMILES OC(=O)Cn1ccc(n1)[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 C5H5N3O4 MW 171.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H5N3O4/c9-5(10)3-7-2-1-4(6-7)8(11)12/h1-2H,3H2,(H,9,10)
InChIKey
CHUMLUJOYBGBEX-UHFFFAOYSA-N
Synonyms
887408-81-3
(3nitro1Hpyrazol1yl)aceticacid
(3NITROPYRAZOL1YL)ACETICACID
1HPYRAZOLE1ACETICACID3NITRO
2(3NITRO1HPYRAZOL1YL)ACETICACID
2(3NITROPYRAZOL1YL)ACETICACID
2(3NITROPYRAZOLYL)ACETICACID
887408813
C1=CN(N=C1(N+)(=O)(O))CC(=O)O
InChI=1SC5H5N3O4c95(10)37214(67)8(11)12h12H3H2(H910)
MFCD01622829
OC(=O)Cn1ccc(n1)(N+)(=O)(O)
ZINC000002381376
ZINC2381376

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Available files

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