4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene
Catalog No: FT-0642599
CAS No: 105529-58-6
- Chemical Name: 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene
- Molecular Formula: C7H3BrF4O
- Molecular Weight: 259.00
- InChI Key: SBSFDYRKNUCGBZ-UHFFFAOYSA-N
- InChI: InChI=1S/C7H3BrF4O/c8-4-1-2-6(5(9)3-4)13-7(10,11)12/h1-3H
| 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-Bromo-2-fluoro-1-(trifluoromethoxy)benzene |
|---|---|
| Flash_Point: | 72.5±10.2 °C |
| Melting_Point: | N/A |
| FW: | 258.996 |
| Density: | 1.7±0.1 g/cm3 |
| CAS: | 105529-58-6 |
| Bolling_Point: | 175.3±35.0 °C at 760 mmHg |
| MF: | C7H3BrF4O |
| Molecular_Structure: | ['1. Molar refractive index 4107 ', '2. Molar volume 1502 ', '3. Parachor (902K)3451 ', '4. Surface tension 278 ', '5. Dielectric constant N/A ', '6. Polarizability 1628 ', '7. Single isotope mass 257930333 Da ', '8. Nominal mass 258 Da ', '9. Average mass 2589957 Da'] |
|---|---|
| LogP: | 4.19 |
| Flash_Point: | 72.5±10.2 °C |
| Refractive_Index: | 1.459 |
| FW: | 258.996 |
| Density: | 1.7±0.1 g/cm3 |
| Bolling_Point: | 175.3±35.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :39 ', '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 92 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :172 ', '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'] |
| PSA: | 9.23000 |
| MF: | C7H3BrF4O |
| More_Info: | ['1 . Appearance Colourless Liquid ', '2 . Density(g/mL,25℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,48mmHg)78 ', '7 . Refractive index(n20/D)Unknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(mmHg,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,25ºC)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: | 1.6±0.3 mmHg at 25°C |
| Exact_Mass: | 257.930328 |
| Risk_Statements(EU): | 36/37/38 |
|---|---|
| HS_Code: | 2909309090 |
| Safety_Statements: | 26-36/37/39 |
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