chempirical

3-Fluoro-2-methylpyridine

C6H6FNCAS 15931-15-4111.12 g/mol

Open in Covalent MOL file
NF
Aryl halide

Properties

Molecular formula
C6H6FN
Molar mass
111.12 g/mol
Exact mass
111.0484 Da
logP
1.53Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
15931-15-4
SMILES
CC1=C(C=CC=N1)F
InChIKey
IRIHSZDBTACXCT-UHFFFAOYSA-N
InChI
InChI=1S/C6H6FN/c1-5-6(7)3-2-4-8-5/h2-4H,1H3

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

Work with 3-Fluoro-2-methylpyridine

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

2,3-Difluoropyridine1513-66-254 % similar 2,3-Lutidine583-61-954 % similar 3-Hydroxy-2-methylpyridine1121-25-150 % similar 2-Chloro-3-fluoropyridine17282-04-150 % similar 8-Fluoroquinoline394-68-348 % similar 3-Fluoro-2-pyridinemethanol31181-79-045 % similar 2,3-Dimethylpyrazine5910-89-443 % similar 1,3-Difluoro-2-methylbenzene443-84-542 % similar

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

Same formula

2-Fluoro-3-methylpyridine2369-18-8 2-Fluoro-5-methylpyridine2369-19-9 2-Fluoroaniline348-54-9 4-Fluoroaniline371-40-4 3-Fluoroaniline372-19-0 2-Fluoro-6-methylpyridine407-22-7 2-Fluoro-4-methylpyridine461-87-0

Elsewhere

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