2,4,6-Trifluoropyridine

C₅H₂F₃NCAS 3512-17-2133.07 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₂F₃N
Molar mass: 133.07 g/mol
Exact mass: 133.0139 Da
Boiling point: 94.5 °C
logP: 1.50Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

3512-17-2

SMILES

Fc1cc(F)nc(F)c1

InChIKey

UZDRWXKBKVVUTE-UHFFFAOYSA-N

InChI

InChI=1S/C5H2F3N/c6-3-1-4(7)9-5(8)2-3/h1-2H

Weigh it out

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

Names and synonyms

1 names

Pyridine, 2,4,6-trifluoro-

Work with 2,4,6-Trifluoropyridine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3,5-Trifluorobenzene372-38-350 % similar 2,4,6-Trifluoropyrimidine696-82-250 % similar 2,4-Difluoropyridine34941-90-748 % similar 2,6-Difluoropyridine1513-65-145 % similar 3,5-Difluorophenol2713-34-043 % similar 2,4,6-Trifluorophenol2268-17-939 % similar 4,6-Difluoropyrimidine2802-62-238 % similar (3,5-Difluorophenyl)boronic acid156545-07-238 % similar

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

Same formula

2,3,6-Trifluoropyridine3512-18-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook