3-Chloro-4-fluorobenzonitrile

3-Chloro-4-fluorobenzonitrile Structure
3-Chloro-4-fluorobenzonitrile structure
Common Name 3-Chloro-4-fluorobenzonitrile
CAS Number 117482-84-5 Molecular Weight 155.557
Density 1.3±0.1 g/cm3 Boiling Point 213.6±20.0 °C at 760 mmHg
Molecular Formula C7H3ClFN Melting Point 69-71 °C(lit.)
MSDS Chinese USA Flash Point 83.0±21.8 °C
Symbol GHS07
GHS07
Signal Word Warning

Molecular structure and vibrational spectra of 3-chloro-4-fluoro benzonitrile by ab initio HF and density functional method.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 71(3) , 1134-9, (2008)

In this work, the experimental and theoretical spectra of 3-chloro-4-fluoro benzonitrile (3C4FBN) were studied. The Fourier transform infrared and Fourier transform Raman spectra of 3C4FBN were recorded in the solid phase. The optimized geometry was calculate...

A novel class of inhibitors for human and rat steroid 5alpha-reductases: synthesis and biological evaluation of indoline and aniline derivatives. III.

Chem. Pharm. Bull. 48(11) , 1689-97, (2000)

While searching for novel nonsteroidal inhibitors of human and rat prostatic 5alpha-reductases, we found a new series of indoline and aniline derivatives that showed potent inhibitory activities for both enzymes. Among them, 3-chloro-4-¿[1-(4-phenoxybenzyl)in...

Synthesis of 3, 4-difluorobenzonitrile and monofluorobenzonitriles by means of halogen-exchange fluorination. Suzuki H and Kimura Y.

J. Fluor. Chem. 52(3) , 341-51, (1991)