5-Fluoro-3-nitro-2(1H)-pyridinone

C5H3FN2O3CAS 136888-20-5158.09 g/mol

Open in Covalent MOL file
ON+O−FNHO
Aryl halideNitroPhenol

Properties

Molecular formula
C5H3FN2O3
Molar mass
158.09 g/mol
Exact mass
158.0128 Da
logP
0.83Crippen estimate
Polar surface area
76.3 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
136888-20-5
SMILES
O=[N+]([O-])c1cc(F)cnc1O
InChIKey
BLFUHTOZIOQGBU-UHFFFAOYSA-N
InChI
InChI=1S/C5H3FN2O3/c6-3-1-4(8(10)11)5(9)7-2-3/h1-2H,(H,7,9)

Weigh it out

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Names and synonyms

3 names
  • 2(1H)-Pyridinone, 5-fluoro-3-nitro-
  • 5-Fluoro-2-hydroxy-3-nitropyridine
  • 5-Fluoro-3-nitropyridin-2-ol

Work with 5-Fluoro-3-nitro-2(1H)-pyridinone

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

3,5-Dinitro-2(1H)-pyridinone2980-33-868 % similar 5-Bromo-3-nitro-2-pyridone15862-34-764 % similar 3-Nitro-5-(trifluoromethyl)-2(1H)-pyridinone33252-64-163 % similar 2-Chloro-5-fluoro-3-nitropyridine136888-21-661 % similar 5-Fluoro-3-nitropyridin-2-amine212268-12-761 % similar 2-Bromo-5-fluoro-3-nitropyridine652160-72-061 % similar 2,6-Dinitro-4-fluorophenol364-32-956 % similar 4-Fluoro-2-nitrophenol394-33-251 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Fluoro-4-nitropyridine N-oxide769-54-0

Elsewhere

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