Trifluoro-p-tolunitrile
Catalog No: FT-0616917
CAS No: 455-18-5
- Molecular Formula: 171.12
- Formula Weight: C8H4F3N
- Inchl Key: DRNJIKRLQJRKMM-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H4F3N/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-4H
| 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: | GHS02, GHS07 |
|---|---|
| CAS: | 455-18-5 |
| Flash_Point: | 71.7±0.0 °C |
| Product_Name: | 4-(Trifluoromethyl)benzonitrile |
| Bolling_Point: | 183.2±0.0 °C at 760 mmHg |
| FW: | 171.119 |
| Melting_Point: | 39-41 °C(lit.) |
| MF: | C8H4F3N |
| Density: | 1.3±0.1 g/cm3 |
| Refractive_Index: | 1.461 |
|---|---|
| Vapor_Pressure: | 0.8±0.3 mmHg at 25°C |
| Flash_Point: | 71.7±0.0 °C |
| LogP: | 2.63 |
| Bolling_Point: | 183.2±0.0 °C at 760 mmHg |
| PSA: | 23.79000 |
| Molecular_Structure: | ['1 . Molar refractive index 3631 ', '2 . Molar volume （m3/mol）1324 ', '3 . Parachor （902K）3150 ', '4 . Surface tension 320 ', '5 . Polarizability （10 -24cm 3）1439'] |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :192 ', '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: | 39-41 °C(lit.) |
| MF: | C8H4F3N |
| Exact_Mass: | 171.029587 |
| FW: | 171.119 |
| Density: | 1.3±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Colourless or 淡Yellow Solid ', '2 . Density（g/ m3,25/4℃）1278 ', '3 . Relative vapor density（g/cm3,Atmosphere =1）Unknow ', '4 . Melting point（ºC）39-41 ', '5 . Boiling point（ºC,Atmospheric pressure）80-81 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index14583 ', '8 . Flash point（ºF）161 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）419 ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 263 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 难Soluble in Water '] |
| Symbol: | GHS02, GHS07 |
|---|---|
| RIDADR: | UN 1325 4.1/PG 2 |
| HS_Code: | 29269095 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R20/21/22 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard_Codes: | Xn:Harmful |
| Warning_Statement: | P210-P280 |
| Safety_Statements: | H228-H302 + H312 + H332 |
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