2,3,4,5,6-Pentafluorobenzoic acid
Names
[ CAS No. ]:
602-94-8
[ Name ]:
2,3,4,5,6-Pentafluorobenzoic acid
[Synonym ]:
Benzoic acid, pentafluoro-
2,3,4,5,6-Pentafluorobenzoic acid
Perfluorobenzoic acid
Pentafluorobenzoic acid
MFCD00002406
Benzoic acid, 2,3,4,5,6-pentafluoro-
QVR BF CF DF EF FF
EINECS 210-026-6
Chemical & Physical Properties
[ Density]:
1.7±0.1 g/cm3
[ Boiling Point ]:
220.0±35.0 °C at 760 mmHg
[ Melting Point ]:
100-102 °C(lit.)
[ Molecular Formula ]:
C7HF5O2
[ Molecular Weight ]:
212.074
[ Flash Point ]:
86.9±25.9 °C
[ Exact Mass ]:
211.989670
[ PSA ]:
37.30000
[ LogP ]:
2.45
[ Vapour Pressure ]:
0.1±0.5 mmHg at 25°C
[ Index of Refraction ]:
1.451
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DH6195000
- CHEMICAL NAME :
- Benzoic acid, pentafluoro-
- CAS REGISTRY NUMBER :
- 602-94-8
- BEILSTEIN REFERENCE NO. :
- 2054395
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H-F5-O2
- MOLECULAR WEIGHT :
- 212.08
- WISWESSER LINE NOTATION :
- QVR BF CF DF EF FF
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 178 mg/kg
- TOXIC EFFECTS :
- Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1020,1968
Safety Information
[ Symbol ]:
GHS06
[ Signal Word ]:
Danger
[ Hazard Statements ]:
H301-H315-H319-H335
[ Precautionary Statements ]:
P261-P301 + P310-P305 + P351 + P338
[ Personal Protective Equipment ]:
Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges
[ Hazard Codes ]:
T:Toxic;
[ Risk Phrases ]:
R25;R36/37/38
[ Safety Phrases ]:
S26-S45-S36/37/39-S24/25
[ RIDADR ]:
UN 2811 6.1/PG 3
[ WGK Germany ]:
3
[ RTECS ]:
DH6195000
[ HS Code ]:
29163900
Synthetic Route
Precursor & DownStream
Precursor
DownStream
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
J. Chromatogr. B. Analyt. Technol. Biomed. Life Sci. 877(31) , 4042-6, (2009)
The development and validation of an analytical method is presented for the determination of bisphenol-A (BPA) and triclosan (TCS), two ubiquitous contaminants, in serum and urine. The glucuronidated ...
Photovalorisation of pentafluorobenzoic acid with platinum doped TiO2.J. Hazard. Mater. 167(1-3) , 763-9, (2009)
Pt-doped TiO(2) has been prepared and characterized by various surface analytical methods such as BET surface area, scanning electron micrographs (SEM), X-ray diffraction (XRD), energy dispersive X-ra...
Dual-domain solute transfer and transport processes: evaluation in batch and transport experiments.J. Contam. Hydrol. 75(3-4) , 257-80, (2004)
Soil macropore networks establish a dual-domain transport scenario in which water and solutes are preferentially channeled through soil macropores while slowly diffusing into and out of the bulk soil ...