

Pentafluorobenzoic acid
Catalog No: FT-0609327
CAS No: 602-94-8
- Molecular Formula: 212.07
- Formula Weight: C6F5COOH
- Inchl Key: YZERDTREOUSUHF-UHFFFAOYSA-N
- Inchl: InChI=1S/C7HF5O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Symbol: | GHS06 |
---|---|
CAS: | 602-94-8 |
Flash_Point: | 86.9±25.9 °C |
Product_Name: | 2,3,4,5,6-Pentafluorobenzoic acid |
Bolling_Point: | 220.0±35.0 °C at 760 mmHg |
FW: | 212.074 |
Melting_Point: | 100-102 °C(lit.) |
MF: | C7HF5O2 |
Density: | 1.7±0.1 g/cm3 |
Refractive_Index: | 1.451 |
---|---|
Vapor_Pressure: | 0.1±0.5 mmHg at 25°C |
Flash_Point: | 86.9±25.9 °C |
LogP: | 2.45 |
Bolling_Point: | 220.0±35.0 °C at 760 mmHg |
FW: | 212.074 |
PSA: | 37.30000 |
Computational_Chemistry: | ['1 . XlogP 2 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 7 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count ', '6 . TPSA 373 ', '7 . Heavy Atom Count 14 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 220 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1'] |
Melting_Point: | 100-102 °C(lit.) |
MF: | C7HF5O2 |
Exact_Mass: | 211.989670 |
Density: | 1.7±0.1 g/cm3 |
More_Info: | ['1 . Appearance White 结晶状粉末 ', '2 . Density(g/mL,20℃)1944 ', '3 气相标准声称热(焓)( kJ·mol-1) -11479 ', '4 . Melting point(ºC)102 ', '5 . Boiling point(ºC,Atmospheric pressure)220 ', '6 晶相标准声称热(焓)( kJ·mol-1)-12396 ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC)219-221 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,18 ºC)Unknow ', '12 . Saturated vapor pressure(kPa,25ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow'] |
Symbol: | GHS06 |
---|---|
RIDADR: | UN 2811 6.1/PG 3 |
HS_Code: | 29163900 |
Risk_Statements(EU): | R25;R36/37/38 |
WGK_Germany: | 3 |
Personal_Protective_Equipment: | Eyeshields;Faceshields;Gloves;type P2 (EN 143) respirator cartridges |
RTECS: | DH6195000 |
Hazard_Codes: | T:Toxic; |
Warning_Statement: | P261-P301 + P310-P305 + P351 + P338 |
Safety_Statements: | H301-H315-H319-H335 |
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