Vitas-M small molecule compound

2-methyl-3-(4-nitro-1H-pyrazol-1-yl)propanoate

Catalog ID
STK312414
SMILES [O-]C(=O)C(Cn1ncc(c1)[N+](=O)[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 C7H8N3O4 MW 198.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H9N3O4/c1-5(7(11)12)3-9-4-6(2-8-9)10(13)14/h2,4-5H,3H2,1H3,(H,11,12)/p-1
InChIKey
VHWODBSEJMYSKU-UHFFFAOYSA-M
Synonyms

(O)C(=O)C(Cn1ncc(c1)(N+)(=O)(O))C
2methyl3(4nitro1Hpyrazol1yl)propanoate
2methyl3(4nitropyrazol1yl)propanoate
CC(CN1C=C(C=N1)(N+)(=O)(O))C(=O)(O)
InChI=1SC7H9N3O4c15(7(11)12)3946(289)10(13)14h245H3H21H3(H1112)p1
MFCD04967200
ZINC000002534244
ZINC000002732134

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Available files

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