Vitas-M small molecule compound
4-nitro-1-(propan-2-yl)-1H-pyrazole-5-carboxylic acid
Catalog ID
STL415189
SMILES CC(n1ncc(c1C(=O)O)[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 C7H9N3O4 MW 199.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H9N3O4/c1-4(2)9-6(7(11)12)5(3-8-9)10(13)14/h3-4H,1-2H3,(H,11,12)InChIKey
VPEGGEVYLRMSKE-UHFFFAOYSA-NSynonyms
1356543-47-91356543479
4nitro1(propan2yl)1Hpyrazole5carboxylicacid
4nitro2propan2ylpyrazole3carboxylicacid
CC(C)N1C(=C(C=N1)(N+)(=O)(O))C(=O)O
CC(n1ncc(c1C(=O)O)(N+)(=O)(O))C
InChI=1SC7H9N3O4c14(2)96(7(11)12)5(389)10(13)14h34H12H3(H1112)
MFCD24540442
ZINC000072339691
ZINC72339691
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