3,5-Difluoronitrobenzene

3,5-Difluoronitrobenzene Structure
3,5-Difluoronitrobenzene structure
Common Name 3,5-Difluoronitrobenzene
CAS Number 2265-94-3 Molecular Weight 159.090
Density 1.5±0.1 g/cm3 Boiling Point 176.5±0.0 °C at 760 mmHg
Molecular Formula C6H3F2NO2 Melting Point 17 °C(lit.)
MSDS Chinese USA Flash Point 73.9±0.0 °C
Symbol GHS07
GHS07
Signal Word Warning

Molecular structure, conformation, and potential to internal rotation of 2,6- and 3,5-difluoronitrobenzene studied by gas-phase electron diffraction and quantum chemical calculations.

J. Phys. Chem. A 112(22) , 5002-9, (2008)

3,5-Difluoronitrobenzene (3,5-DFNB) and 2,6-difluoronitrobenzene (2,6-DFNB) have been studied by gas-phase electron diffraction (GED), MP2 ab initio, and by B3LYP density functional calculations. Refinements of r h1 and r e static and r h1 dynamic GED models ...