4-(Trifluoromethoxy)benzonitrile
Catalog No: FT-0616881
CAS No: 332-25-2
- Molecular Formula: 187.12
- Formula Weight: C8H4F3NO
- Inchl Key: XWHIXOMWXCHJPP-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H4F3NO/c9-8(10,11)13-7-3-1-6(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: | GHS07 |
|---|---|
| CAS: | 332-25-2 |
| Flash_Point: | 82.8±0.0 °C |
| Product_Name: | 4-(Trifluoromethoxy)benzonitrile |
| Bolling_Point: | 192.5±0.0 °C at 760 mmHg |
| FW: | 187.119 |
| Melting_Point: | N/A |
| MF: | C8H4F3NO |
| Density: | 1.3±0.1 g/cm3 |
| Refractive_Index: | 1.461 |
|---|---|
| Vapor_Pressure: | 0.5±0.3 mmHg at 25°C |
| Flash_Point: | 82.8±0.0 °C |
| LogP: | 2.91 |
| Bolling_Point: | 192.5±0.0 °C at 760 mmHg |
| FW: | 187.119 |
| PSA: | 33.02000 |
| Computational_Chemistry: | ['1. XlogP :28 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 33 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :209 ', '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: | C8H4F3NO |
| Exact_Mass: | 187.024506 |
| Molecular_Structure: | ['1 . Molar refractive index 3805 ', '2 . Molar volume （m3/mol）1387 ', '3 . Parachor （902K）3353 ', '4 . Surface tension 341 ', '5 . Polarizability （10 -24cm 3）1508'] |
| Density: | 1.3±0.1 g/cm3 |
| More_Info: | ['一物性数据 ', '. Appearance Colourless 透明Liquid ', '. Density（g/mL,25/4℃）1285 ', '. Relative vapor density（g/mL,Atmosphere =1）不可用 ', '. Melting point（ºC）不可用 ', '. Boiling point（ºC,Atmospheric pressure）不可用 ', '. Boiling point（ºC,52kPa）192-193 ', '. Refractive index1451-1453 ', '. Flash point（ºC）82 ', '. Specific rotation（º）不可用 ', '. Spontaneous ignition point or ignition temperature（ºC）不可用 ', '. Vapor pressure（kPa,25ºC）不可用 ', '. Saturated vapor pressure（kPa,60ºC）不可用 ', '. Combustion heat（KJ/mol）不可用 ', '. Critical temperature（ºC）不可用 ', '. Critical pressure（KPa）不可用 ', '. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不可用 ', '. Upper limit of explosion（%,V/V）不可用 ', '. Lower limit of explosion（%,V/V）不可用 ', '. Solubility 不可用'] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | 3276 |
| HS_Code: | 2926909090 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard_Codes: | Xn:Harmful; |
| Warning_Statement: | P261-P280-P305 + P351 + P338 |
| Safety_Statements: | H302-H312-H315-H319-H332-H335 |
