2,3,4,6-Tetrafluoropyridine

C₅HF₄NCAS 3512-13-8151.06 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅HF₄N
Molar mass: 151.06 g/mol
Exact mass: 151.0045 Da
logP: 1.64Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number

3512-13-8

SMILES

C1=C(C(=C(N=C1F)F)F)F

InChIKey

NOQFPTRRIPJRMG-UHFFFAOYSA-N

InChI

InChI=1S/C5HF4N/c6-2-1-3(7)10-5(9)4(2)8/h1H

Weigh it out

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

Work with 2,3,4,6-Tetrafluoropyridine

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

2,3,6-Trifluoropyridine3512-18-348 % similar Pentafluorobenzene363-72-442 % similar Pentafluoropyridine700-16-342 % similar 2,3,5,6-Tetrafluorophenol769-39-141 % similar 3,4,5-Trifluorophenol99627-05-141 % similar 2,2′,3,3′,5,5′,6,6′-Octafluoro-1,1′-biphenyl3883-86-140 % similar 1,2,3,5-Tetrafluorobenzene2367-82-038 % similar 2,4,6-Trifluoropyridine3512-17-238 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,3,5,6-Tetrafluoropyridine2875-18-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook