2-Fluoro-4-(trifluoromethyl)benzoic acid

Names

[ Name ]:
2-Fluoro-4-(trifluoromethyl)benzoic acid

[Synonym ]:
2-Fluoro-4-(trifluoromethyl)benzoic acid
QVR BF DXFFF
Benzoic acid, 2-fluoro-4-(trifluoromethyl)-
MFCD00010322
α,α,α,2-Tetrafluoro-p-toluic acid

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
231.4±40.0 °C at 760 mmHg

[ Melting Point ]:
168-170 °C(lit.)

[ Molecular Formula ]:
C₈H₄F₄O₂

[ Molecular Weight ]:
208.110

[ Flash Point ]:
93.7±27.3 °C

[ Exact Mass ]:
208.014740

[ PSA ]:
37.30000

[ LogP ]:
2.90

[ Vapour Pressure ]:
0.0±0.5 mmHg at 25°C

[ Index of Refraction ]:
1.459

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38;R36/38

[ Safety Phrases ]:
S26-S37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ HS Code ]:
2916399090

Customs

[ HS Code ]: 2916399090

[ Summary ]:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles

Quantitative structure-metabolism relationships for substituted benzoic acids in the rat. Computational chemistry, NMR spectroscopy and pattern recognition studies.

Biochem. Pharmacol. 44(10) , 1935-46, (1992)

An extensive set of computed molecular properties, both steric and electronic, have been calculated using molecular orbital and empirical methods for benzoic acid (1) and a congeneric series of substi...