4-Hydroxy-3-nitropyridine N-oxide

C₅H₄N₂O₄CAS 31872-57-8156.10 g/mol

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Properties

Molecular formula: C₅H₄N₂O₄
Molar mass: 156.10 g/mol
Exact mass: 156.0171 Da
logP: -0.07Crippen estimate
Polar surface area: 90.3 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

Identifiers

CAS number

31872-57-8

SMILES

O=[N+]([O-])c1c[n+]([O-])ccc1O

InChIKey

GFWANJBZRUUAPA-UHFFFAOYSA-N

InChI

InChI=1S/C5H4N2O4/c8-5-1-2-6(9)3-4(5)7(10)11/h1-3,8H

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Names and synonyms

2 names

4-Pyridinol, 3-nitro-, 1-oxide
NSC 41627

Work with 4-Hydroxy-3-nitropyridine N-oxide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Nitro-3-methylpyridine N-oxide1074-98-257 % similar 3-Fluoro-4-nitropyridine N-oxide769-54-057 % similar Nitrophenol88-75-553 % similar 4-Nitropyridine-N-oxide1124-33-050 % similar 2,4-Dinitrophenol51-28-549 % similar 4-Fluoro-2-nitrophenol394-33-247 % similar 4,6-Dinitroresorcinol616-74-047 % similar 4-Methyl-2-nitrophenol119-33-546 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,2,3,4-Tetrahydro-2,4-dioxo-5-pyrimidinecarboxylic acid23945-44-0 Pyrazole-3,5-dicarboxylic acid3112-31-0 Imidazole-4,5-dicarboxylic acid570-22-9 Orotic acid65-86-1

Elsewhere

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