2-Fluoro-6-(4-fluorophenoxy)benzonitrile

C13H7F2NOCAS 175204-07-6231.20 g/mol

Open in Covalent MOL file
FNOF
Aryl halideEtherNitrile

Properties

Molecular formula
C13H7F2NO
Molar mass
231.20 g/mol
Exact mass
231.0496 Da
logP
3.63Crippen estimate
Polar surface area
33.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

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
175204-07-6
SMILES
C1=CC(=C(C(=C1)F)C#N)OC2=CC=C(C=C2)F
InChIKey
NOPNZSQHYZPSSX-UHFFFAOYSA-N
InChI
InChI=1S/C13H7F2NO/c14-9-4-6-10(7-5-9)17-13-3-1-2-12(15)11(13)8-16/h1-7H

Weigh it out

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

Work with 2-Fluoro-6-(4-fluorophenoxy)benzonitrile

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-Fluoro-6-phenoxybenzonitrile175204-06-579 % similar 2-Fluoro-6-(4-methylphenoxy)benzonitrile175204-08-774 % similar 2-Fluoro-6-[4-(methylthio)phenoxy]benzonitrile148901-52-468 % similar 2-Fluoro-6-methoxybenzonitrile94088-46-758 % similar 2,6-Difluorobenzonitrile1897-52-555 % similar 2-Fluoro-6-(2,2,2-trifluoroethoxy)benzonitrile119584-74-651 % similar 2-Amino-6-fluorobenzonitrile77326-36-450 % similar 3-Fluoro-1,2-benzenedicarbonitrile65610-13-149 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook