2,5-Difluoropyridine

C₅H₃F₂NCAS 84476-99-3115.08 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₅H₃F₂N
Molar mass: 115.08 g/mol
Exact mass: 115.0234 Da
logP: 1.36Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vapor95.7% of notifiers
H315 Causes skin irritation97.8% of notifiers
H319 Causes serious eye irritation97.8% of notifiers
H335 May cause respiratory irritation95.7% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number

84476-99-3

SMILES

C1=CC(=NC=C1F)F

InChIKey

XFAMUOYNXFXQTC-UHFFFAOYSA-N

InChI

InChI=1S/C5H3F2N/c6-4-1-2-5(7)8-3-4/h1-3H

Weigh it out

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

Work with 2,5-Difluoropyridine

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-Chloro-5-fluoropyridine31301-51-658 % similar 5-Fluoro-2(1H)-pyridinone51173-05-858 % similar 6-Fluoropyridin-3-ol55758-32-254 % similar 5-Chloro-2-fluoropyridine1480-65-552 % similar 5-Fluoro-2-iodopyridine159870-80-152 % similar 2-Fluoro-5-iodopyridine171197-80-152 % similar 6-Fluoro-3-pyridinamine1827-27-652 % similar 2-Amino-5-fluoropyridine21717-96-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Difluoropyridine1513-65-1 2,3-Difluoropyridine1513-66-2 2,4-Difluoropyridine34941-90-7 3,5-Difluoropyridine71902-33-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook