chempirical

3-Fluoro-2-(trifluoromethyl)pyridine

C6H3F4NCAS 886510-21-0165.09 g/mol

Open in Covalent MOL file
NFFFF
Alkyl halideAryl 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 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
886510-21-0
SMILES
C1=CC(=C(N=C1)C(F)(F)F)F
InChIKey
OQNWCFXTGANWQI-UHFFFAOYSA-N
InChI
InChI=1S/C6H3F4N/c7-4-2-1-3-11-5(4)6(8,9)10/h1-3H

Weigh it out

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

Names and synonyms

1 names
  • 3-Fluoro-2-trifluoromethylpyridine

Work with 3-Fluoro-2-(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

2,3-Bis(trifluoromethyl)pyridine1644-68-461 % similar 2-Amino-3-fluoropyridine21717-95-352 % similar 2,3-Difluoropyridine1513-66-250 % similar 2-(Trifluoromethyl)nicotinic acid131747-43-847 % similar 3-Fluoro-2-iodopyridine146141-04-047 % similar 3-Fluoro-2-methylpyridine15931-15-447 % similar 2-Chloro-3-fluoropyridine17282-04-147 % similar 2-Bromo-3-fluoropyridine40273-45-847 % 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 2-Fluoro-6-(trifluoromethyl)pyridine94239-04-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook