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

C₅H₃FN₂O₃CAS 136888-20-5158.09 g/mol

Open in Covalent MOL file

Aryl halide Nitro Phenol

Properties

Molecular formula: C₅H₃FN₂O₃
Molar mass: 158.09 g/mol
Exact mass: 158.0128 Da
logP: 0.83Crippen estimate
Polar surface area: 76.3 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 1

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

Type any one amount. The others follow from the molar mass.

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(1H)-pyridinone15862-34-764 % similar 3-Nitro-5-(trifluoromethyl)-2(1H)-pyridinone33252-64-163 % similar 4-Fluoro-2-nitrophenol394-33-251 % similar 3-Nitro-2(1H)-pyridinone6332-56-551 % similar 2,4-Difluoro-6-nitrophenol364-31-850 % similar 5-Fluoro-2-nitrophenol446-36-650 % similar 5-Nitro-2,4(1H,3H)-pyrimidinedione611-08-550 % 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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