2-Fluoro-4-(trifluoromethyl)pyridine

C₆H₃F₄NCAS 118078-66-3165.09 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

Identifiers

CAS number

118078-66-3

SMILES

C1=CN=C(C=C1C(F)(F)F)F

InChIKey

DFNQBXZKPUBEIX-UHFFFAOYSA-N

InChI

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

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

Names and synonyms

1 names

2-Fluoro-4-trifluoromethyl-pyridine

Work with 2-Fluoro-4-(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

4-(Trifluoromethyl)-2(1H)-pyridinone50650-59-462 % similar 2-Amino-4-(trifluoromethyl)pyridine106447-97-657 % similar 2-Bromo-4-(trifluoromethyl)pyridine175205-81-957 % similar 2-Chloro-4-(trifluoromethyl)pyridine81565-18-657 % similar 2,4-Difluoropyridine34941-90-750 % similar 4-(Trifluoromethyl)pyridine3796-24-548 % similar 4-Bromo-2-fluoropyridine128071-98-747 % similar 2-Fluoro-4-iodopyridine22282-70-847 % similar

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

Same formula

3-Fluoro-4-(trifluoromethyl)pyridine113770-87-9 2,3,4,6-Tetrafluorobenzenamine363-73-5 2-Fluoro-5-(trifluoromethyl)pyridine69045-82-5 2,3,5,6-Tetrafluorobenzenamine700-17-4 2-Fluoro-6-(trifluoromethyl)pyridine94239-04-0

Elsewhere

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