2,4,6-Trifluoropyridine

C5H2F3NCAS 3512-17-2133.07 g/mol

Open in Covalent MOL file
FFNF
Aryl halide

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 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)

Aggregated from 11 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501

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

4-Amino-2,6-difluoropyridine63489-58-752 % similar 2,6-Difluoro-4-iodopyridine685517-71-952 % similar 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

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3,6-Trifluoropyridine3512-18-3 3,4,5-Trifluoropyridine67815-54-7 2,3,5-Trifluoropyridine76469-41-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook