2-Triflnoromethoxybenzyl cyanide
Catalog No: FT-0608948
CAS No: 137218-25-8
- Molecular Formula: 201.14
- Formula Weight: C9H6F3NO
- Inchl Key: OIKWCWVMUBCXJM-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H6F3NO/c10-9(11,12)14-8-4-2-1-3-7(8)5-6-13/h1-4H,5H2
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | N/A |
|---|---|
| CAS: | 137218-25-8 |
| MF: | C9H6F3NO |
| Flash_Point: | >230 °F |
| Product_Name: | 2-Triflnoromethoxybenzyl cyanide |
| Density: | 1.28 g/mL at 25 °C(lit.) |
| FW: | 201.14500 |
| Bolling_Point: | 222-223 °C(lit.) |
| Refractive_Index: | n20/D 1.449(lit.) |
|---|---|
| Vapor_Pressure: | 0.175mmHg at 25°C |
| Flash_Point: | >230 °F |
| LogP: | 2.65128 |
| Bolling_Point: | 222-223 °C(lit.) |
| PSA: | 33.02000 |
| Molecular_Structure: | ['1. Molar refractive index 4285 ', '2. Molar volume 156 ', '3. Parachor （902K）3724 ', '4. Surface tension 324 ', '5. Dielectric constant N/A ', '6. Polarizability 1698 ', '7. Single isotope mass 201040148 Da ', '8. Nominal mass 201 Da ', '9. Average mass 2011452 Da'] |
| Computational_Chemistry: | ['1. XlogP :28 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 33 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :230 ', '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'] |
| MF: | C9H6F3NO |
| Exact_Mass: | 201.04000 |
| FW: | 201.14500 |
| Density: | 1.28 g/mL at 25 °C(lit.) |
| More_Info: | ['1 . Appearance Colourless 的Liquid ', '2 . Density（g/mL,20℃）128 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）222-223 ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexn20/D 1449 ', '8 . Flash point（ºC）>110 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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 Insoluble in Water '] |
| Hazard_Class: | 6.1 |
|---|---|
| Risk_Statements(EU): | R20/21/22;R36/38 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Gloves |
| RIDADR: | 3276 |
| Hazard_Codes: | T |
| HS_Code: | 2926909090 |
| Safety_Statements: | S26-S36/37/39 |
| Packing_Group: | III |
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