2,3,6-TRIFLUOROBENZOIC ACID

2,3,6-TRIFLUOROBENZOIC ACID Structure
2,3,6-TRIFLUOROBENZOIC ACID structure
Common Name 2,3,6-TRIFLUOROBENZOIC ACID
CAS Number 2358-29-4 Molecular Weight 176.093
Density 1.5±0.1 g/cm3 Boiling Point 233.5±35.0 °C at 760 mmHg
Molecular Formula C7H3F3O2 Melting Point 130-131 °C(lit.)
MSDS Chinese USA Flash Point 95.0±25.9 °C
Symbol GHS07
GHS07
Signal Word Warning

FTIR and Raman spectra and optimized geometry of 2,3,6-tri-fluorobenzoic acid dimer: a DFT and SQMFF study.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 77(4) , 787-94, (2010)

Raman and FTIR spectra of the 2,3,6-tri-fluorobenzoic acid molecule have been recorded in the regions 50-4000cm⁻¹ and 400-4000cm⁻¹, respectively. Vibrational frequencies have been calculated by employing DFT method in dimeric form in optimum state. SQM force ...