chempirical

2-Fluoro-5-nitro-6-picoline

C6H5FN2O2CAS 18605-16-8156.12 g/mol

Open in Covalent MOL file
NFN+OO−
Aryl halideNitro

Properties

Molecular formula
C6H5FN2O2
Molar mass
156.12 g/mol
Exact mass
156.0335 Da
logP
1.44Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Identifiers

CAS number
18605-16-8
SMILES
CC1=C(C=CC(=N1)F)[N+](=O)[O-]
InChIKey
JVLRFRZVCOWBDY-UHFFFAOYSA-N
InChI
InChI=1S/C6H5FN2O2/c1-4-5(9(10)11)2-3-6(7)8-4/h2-3H,1H3

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Names and synonyms

1 names
  • 6-Fluoro-2-methyl-3-nitropyridine

Work with 2-Fluoro-5-nitro-6-picoline

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

2,6-Dimethyl-3-nitropyridine15513-52-765 % similar 6-Chloro-2-methyl-3-nitropyridine22280-60-061 % similar 6-Bromo-2-methyl-3-nitropyridine22282-96-861 % similar 2-Methoxy-6-methyl-3-nitropyridine112163-03-846 % similar 4-Fluoro-2-methyl-1-nitrobenzene446-33-346 % similar 2-Fluoro-4-methyl-1-nitrobenzene446-34-446 % similar 2-Bromo-6-methyl-3-nitropyridine374633-31-545 % similar 2-Fluoro-5-nitropyridine456-24-645 % similar

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

Same formula

5-Amino-2-fluoro-isonicotinic acid171178-43-1 2-Fluoro-6-nitrobenzenamine17809-36-8 2-Fluoro-3-nitro-4-picoline19346-43-1 2-Fluoro-6-methyl-3-nitropyridine19346-45-3 2-Fluoro-3-methyl-5-nitropyridine19346-46-4 2-Fluoro-4-methyl-5-nitropyridine19346-47-5 5-Fluoro-2-nitrobenzenamine2369-11-1 3-Fluoro-5-nitrobenzenamine2369-12-2

Elsewhere

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