2-Fluoro-6-(trifluoromethyl)pyridine

C₆H₃F₄NCAS 94239-04-0165.09 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₆H₃F₄N
Molar mass: 165.09 g/mol
Exact mass: 165.0202 Da
logP: 2.24Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Hazards

Warning

H226 Flammable liquid and vaporFlammable liquids
H302 Harmful if swallowedAcute toxicity, oral
H332 Harmful if inhaledAcute toxicity, inhalation
H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 613-245-00-9), via PubChem.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P273, P280, P301+P317, P303+P361+P353, P304+P340, P317, P330, P370+P378, P403+P235, P501

Identifiers

CAS number

94239-04-0

SMILES

Fc1cccc(C(F)(F)F)n1

InChIKey

IZOIOCQPMHHDHN-UHFFFAOYSA-N

InChI

InChI=1S/C6H3F4N/c7-5-3-1-2-4(11-5)6(8,9)10/h1-3H

Weigh it out

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

Names and synonyms

3 names

Pyridine, 2-fluoro-6-(trifluoromethyl)-
2-Fluoro-6-trifluoromethylpyridine
6-Trifluoromethyl-2-fluoropyridine

Work with 2-Fluoro-6-(trifluoromethyl)pyridine

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

2,6-Bis(trifluoromethyl)pyridine455-00-570 % similar 2-Chloro-6-(trifluoromethyl)pyridine39890-95-457 % similar 2,6-Difluoropyridine1513-65-157 % similar 2-Bromo-6-(trifluoromethyl)pyridine189278-27-155 % similar 2-Amino-6-(trifluoromethyl)pyridine34486-24-355 % similar 6-Trifluoromethyl-2-pyridinecarboxylic acid131747-42-750 % similar 2-Chloro-6-fluoropyridine20885-12-546 % similar 2-Chloro-4-(trifluoromethyl)pyrimidine33034-67-245 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Fluoro-4-(trifluoromethyl)pyridine113770-87-9 2-Fluoro-4-(trifluoromethyl)pyridine118078-66-3 2,3,4,6-Tetrafluorobenzenamine363-73-5 2,3,4,5-Tetrafluoroaniline5580-80-3 2-Fluoro-3-(trifluoromethyl)pyridine65753-52-8 2-Fluoro-5-(trifluoromethyl)pyridine69045-82-5 2,3,5,6-Tetrafluorobenzenamine700-17-4 3-Fluoro-2-(trifluoromethyl)pyridine886510-21-0

Elsewhere

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