

2,3,6-Trifluorophenylacetic acid
Catalog No: FT-0601641
CAS No: 114152-23-7
- Molecular Formula: 190.12
- Formula Weight: C8H5F3O2
- Inchl Key: QRAZASHLGLHKEB-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H5F3O2/c9-5-1-2-6(10)8(11)4(5)3-7(12)13/h1-2H,3H2,(H,12,13)
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: | GHS07 |
---|---|
CAS: | 114152-23-7 |
Flash_Point: | 104.7±25.9 °C |
Product_Name: | 2,3,6-Trifluorophenylacetic acid |
Bolling_Point: | 249.5±35.0 °C at 760 mmHg |
FW: | 190.119 |
Melting_Point: | 111-114 °C(lit.) |
MF: | C8H5F3O2 |
Density: | 1.5±0.1 g/cm3 |
Refractive_Index: | 1.489 |
---|---|
Vapor_Pressure: | 0.0±0.5 mmHg at 25°C |
Flash_Point: | 104.7±25.9 °C |
LogP: | 1.67 |
Bolling_Point: | 249.5±35.0 °C at 760 mmHg |
PSA: | 37.30000 |
Molecular_Structure: | ['1. Molar refractive index 3734 ', '2. Molar volume 1295 ', '3. Parachor (902K)327 ', '4. Surface tension 406 ', '5. Dielectric constant N/A ', '6. Polarizability 148 ', '7. Single isotope mass 190024164 Da ', '8. Nominal mass 190 Da ', '9. Average mass 1901193 Da'] |
Computational_Chemistry: | ['1. XlogP :17 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :198 ', '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: | 111-114 °C(lit.) |
MF: | C8H5F3O2 |
Exact_Mass: | 190.024170 |
FW: | 190.119 |
Density: | 1.5±0.1 g/cm3 |
More_Info: | ['1 . Appearance Unknow ', '2 . Density(g/mL,25℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)111-114 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,10mmHg)Unknow ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(mmHg,20ºC)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: | GHS07 |
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Risk_Statements(EU): | R36/37/38 |
HS_Code: | 2916399090 |
WGK_Germany: | 3 |
Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
RIDADR: | NONH for all modes of transport |
Hazard_Codes: | Xi: Irritant; |
Warning_Statement: | P261-P305 + P351 + P338 |
Safety_Statements: | H315-H319-H335 |
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