Vitas-M small molecule compound
1-(2,2-difluoroethyl)-3-nitro-1H-pyrazole-4-carboxylic acid
Catalog ID
STL415342
SMILES FC(Cn1cc(c(n1)[N+](=O)[O-])C(=O)O)F
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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 C6H5F2N3O4 MW 221.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H5F2N3O4/c7-4(8)2-10-1-3(6(12)13)5(9-10)11(14)15/h1,4H,2H2,(H,12,13)InChIKey
DVKPUCKMLLKMJE-UHFFFAOYSA-NSynonyms
1798678-71-31(22difluoroethyl)3nitro1Hpyrazole4carboxylicacid
1798678713
C1=C(C(=NN1CC(F)F)(N+)(=O)(O))C(=O)O
FC(Cn1cc(c(n1)(N+)(=O)(O))C(=O)O)F
InChI=1SC6H5F2N3O4c74(8)21013(6(12)13)5(910)11(14)15h14H2H2(H1213)
MFCD28155643
ZINC000095836858
ZINC95836858
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