2-Chloro-4-(trifluoromethyl)benzonitrile
Catalog No: FT-0615377
CAS No: 1813-33-8
- Molecular Formula: 205.56
- Formula Weight: C8H3ClF3N
- Inchl Key: GEHMLBFNZKJDQM-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H3ClF3N/c9-7-3-6(8(10,11)12)2-1-5(7)4-13/h1-3H
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Product_Name: | 3-Chloro-4-cyano-benzotrifluoride |
|---|---|
| Flash_Point: | 92.9±27.3 °C |
| Melting_Point: | 82-83°C/8mm |
| FW: | 205.564 |
| Density: | 1.4±0.1 g/cm3 |
| CAS: | 1813-33-8 |
| Bolling_Point: | 230.0±40.0 °C at 760 mmHg |
| MF: | C8H3ClF3N |
| Flash_Point: | 92.9±27.3 °C |
|---|---|
| Refractive_Index: | 1.485 |
| FW: | 205.564 |
| Density: | 1.4±0.1 g/cm3 |
| Bolling_Point: | 230.0±40.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :32 ', '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 :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :229 ', '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'] |
| LogP: | 3.38 |
| Melting_Point: | 82-83°C/8mm |
| PSA: | 23.79000 |
| MF: | C8H3ClF3N |
| More_Info: | ['1 . Appearance 灰Yellow Liquid ', '2 . Density（g/mL,25 ºC）1389 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow 5 . Boiling point（ ºC, Atmospheric pressure）192-193 6 . Boiling point（ ºC,52kPa ）Unknow 7 . Refractive index14840 8 . Flash point（ ºF ）>220 ', '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）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'] |
| Vapor_Pressure: | 0.1±0.5 mmHg at 25°C |
| Exact_Mass: | 204.990616 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US) |
|---|---|
| Hazard_Codes: | Xn:Harmful; |
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| RIDADR: | 3276 |
| HS_Code: | 2926909090 |
| WGK_Germany: | 3 |
| Safety_Statements: | S26-S36/37/39 |
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