4-(TRIFLUOROMETHYLTHIO)PHENYLACETONITRILE
Catalog No: FT-0641267
CAS No: 70124-90-2
- Chemical Name: 4-(TRIFLUOROMETHYLTHIO)PHENYLACETONITRILE
- Molecular Formula: C9H6F3NS
- Molecular Weight: 217.21
- InChI Key: HZIDFDPCOAUCGK-UHFFFAOYSA-N
- InChI: InChI=1S/C9H6F3NS/c10-9(11,12)14-8-3-1-7(2-4-8)5-6-13/h1-4H,5H2
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Product_Name: | {4-[(Trifluoromethyl)sulfanyl]phenyl}acetonitrile |
|---|---|
| Bolling_Point: | 218.5±40.0 °C at 760 mmHg |
| Density: | 1.3±0.1 g/cm3 |
| MF: | C9H6F3NS |
| CAS: | 70124-90-2 |
| Melting_Point: | N/A |
| Flash_Point: | 86.0±27.3 °C |
| FW: | 217.211 |
| MF: | C9H6F3NS |
|---|---|
| Bolling_Point: | 218.5±40.0 °C at 760 mmHg |
| Exact_Mass: | 217.017303 |
| Refractive_Index: | 1.513 |
| PSA: | 49.09000 |
| Flash_Point: | 86.0±27.3 °C |
| Computational_Chemistry: | ['1. XlogP :N/A ', '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 491 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :222 ', '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'] |
| Density: | 1.3±0.1 g/cm3 |
| Molecular_Structure: | ['1 . Molar refractive index 4895 ', '2 . Molar volume 1629 ', '3 . Parachor （902K）4074 ', '4 . Surface tension 391 ', '5 . Polarizability 1940 ', '6 . Dielectric constant 未确定'] |
| FW: | 217.211 |
| LogP: | 2.80 |
| Vapor_Pressure: | 0.1±0.4 mmHg at 25°C |
| Risk_Statements(EU): | 36/37/38 |
|---|---|
| Hazard_Codes: | Xi,T |
| HS_Code: | 2930909090 |
| Safety_Statements: | S26-S36 |
| WGK_Germany: | 3 |
| RIDADR: | 3276 |
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