chempirical

2-Fluoro-4-methyl-5-nitropyridine

C6H5FN2O2CAS 19346-47-5156.12 g/mol

Open in Covalent MOL file
NN+OO−F
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
19346-47-5
SMILES
CC1=CC(=NC=C1[N+](=O)[O-])F
InChIKey
NSKQWXVTBOPEMH-UHFFFAOYSA-N
InChI
InChI=1S/C6H5FN2O2/c1-4-2-6(7)8-3-5(4)9(10)11/h2-3H,1H3

Weigh it out

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Work with 2-Fluoro-4-methyl-5-nitropyridine

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-Methyl-5-nitro-2(1H)-pyridinone21901-41-767 % similar 2-Chloro-4-methyl-5-nitropyridine23056-33-962 % similar 2-Bromo-4-methyl-5-nitropyridine23056-47-562 % similar 1,2-Difluoro-4-methyl-5-nitrobenzene127371-50-056 % similar 4-Fluoro-1-methyl-2-nitrobenzene446-10-654 % similar 4-Methyl-3-nitropyridine5832-44-054 % similar 4-Fluoro-2-methyl-1-nitrobenzene446-33-353 % similar 1-Chloro-2-fluoro-4-methyl-5-nitrobenzene118664-99-649 % 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-5-nitro-6-picoline18605-16-8 2-Fluoro-3-nitro-4-picoline19346-43-1 2-Fluoro-6-methyl-3-nitropyridine19346-45-3 2-Fluoro-3-methyl-5-nitropyridine19346-46-4 5-Fluoro-2-nitrobenzenamine2369-11-1 3-Fluoro-5-nitrobenzenamine2369-12-2

Elsewhere

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