3-(DIFLUOROMETHOXY)BENZONITRILE
Catalog No: FT-0642343
CAS No: 97582-88-2
- Chemical Name: 3-(DIFLUOROMETHOXY)BENZONITRILE
- Molecular Formula: C8H5F2NO
- Molecular Weight: 169.13
- InChI Key: JCBOPIBHZFBHQW-UHFFFAOYSA-N
- InChI: InChI=1S/C8H5F2NO/c9-8(10)12-7-3-1-2-6(4-7)5-11/h1-4,8H
| 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: | 3-(Difluoromethoxy)benzonitrile |
|---|---|
| Flash_Point: | 84.5±25.9 °C |
| Melting_Point: | N/A |
| FW: | 169.128 |
| Density: | 1.3±0.1 g/cm3 |
| CAS: | 97582-88-2 |
| Bolling_Point: | 216.2±35.0 °C at 760 mmHg |
| MF: | C8H5F2NO |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 3790 ', '2 . Molar volume (m3/mol)1337 ', '3 . Parachor (902K)3278 ', '4 . Surface tension 361 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 1502'] |
|---|---|
| Flash_Point: | 84.5±25.9 °C |
| Refractive_Index: | 1.479 |
| FW: | 169.128 |
| Density: | 1.3±0.1 g/cm3 |
| Bolling_Point: | 216.2±35.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 33 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :187 ', '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: | 1.63 |
| PSA: | 33.02000 |
| MF: | C8H5F2NO |
| More_Info: | ['1 . Appearance Solid ', '2 . Density(g/mL,25ºC)1260 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC)224-225 ', '6 . Boiling point(ºC,01mmHg)Unknow ', '7 . Refractive indexn 20/D 14870(lit) ', '8 . Flash point(°F)>230°F ', '9 . Specific rotation(ºF)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,110ºC)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±0.4 mmHg at 25°C |
| Exact_Mass: | 169.033920 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard_Codes: | T: Toxic; |
| Risk_Statements(EU): | R20/21/22 |
| RIDADR: | 3276 |
| HS_Code: | 2926909090 |
| WGK_Germany: | 3 |
| Safety_Statements: | S26-S36/37/39 |
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