3-Bromo-2-fluorobenzoic acid
Catalog No: FT-0601249
CAS No: 161957-56-8
- Molecular Formula: 219.01
- Formula Weight: C7H4BrFO2
- Inchl Key: UVKURTLVTLRSSM-UHFFFAOYSA-N
- Inchl: InChI=1S/C7H4BrFO2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11)
| 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-Bromo-2-fluorobenzoic acid |
|---|---|
| Flash_Point: | 134.1±23.2 °C |
| Melting_Point: | 168 °C |
| FW: | 219.008 |
| Density: | 1.8±0.1 g/cm3 |
| CAS: | 161957-56-8 |
| Bolling_Point: | 298.2±25.0 °C at 760 mmHg |
| MF: | C7H4BrFO2 |
| Flash_Point: | 134.1±23.2 °C |
|---|---|
| Refractive_Index: | 1.583 |
| FW: | 219.008 |
| Density: | 1.8±0.1 g/cm3 |
| Bolling_Point: | 298.2±25.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :22 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :163 ', '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: | 2.59 |
| Melting_Point: | 168 °C |
| PSA: | 37.30000 |
| MF: | C7H4BrFO2 |
| More_Info: | ['1 . Appearance 晶体状粉末 ', '2 . Density（g/mL, 20 ℃ ）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）155 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC 20mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºF）Unknow ', '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: | 0.0±0.7 mmHg at 25°C |
| Exact_Mass: | 217.937866 |
| Hazard_Codes: | Xi |
|---|---|
| HS_Code: | 2916399090 |
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