2,3,6-Trifluoropyridine

C₅H₂F₃NCAS 3512-18-3133.07 g/mol

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Properties

Molecular formula: C₅H₂F₃N
Molar mass: 133.07 g/mol
Exact mass: 133.0139 Da
Melting point: 115–116 °C
Boiling point: 115–117 °C
logP: 1.50Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

3512-18-3

SMILES

Fc1ccc(F)c(F)n1

InChIKey

HRLIANGJWPJFKW-UHFFFAOYSA-N

InChI

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

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

Names and synonyms

1 names

Pyridine, 2,3,6-trifluoro-

Work with 2,3,6-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

2,3,5,6-Tetrafluoropyridine2875-18-548 % similar 2,6-Difluoropyridine1513-65-143 % similar 2,3-Difluoropyridine1513-66-241 % similar 2,6-Difluoro-3-(4,4,5,5-tetramethyl-[1,3,2]-dioxaborolan-2-yl)pyridine1072945-00-640 % similar 2-Bromo-3,5,6-trifluoropyridine1186194-66-038 % similar 2-Pyridinamine,5-fluoro-6-methyl-(9ci)110919-71-635 % similar 6-Bromo-3-fluoro-2-methylpyridine374633-38-235 % similar 3-Bromo-6-fluoro-2-methylpyridine375368-83-535 % similar

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

Same formula

2,4,6-Trifluoropyridine3512-17-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook