4-Bromo-2-fluorobenzonitrile
Catalog No: FT-0600974
CAS No: 105942-08-3
- Chemical Name: 4-Bromo-2-fluorobenzonitrile
- Molecular Formula: C7H3BrFN
- Molecular Weight: 200.01
- InChI Key: HGXWRDPQFZKOLZ-UHFFFAOYSA-N
- InChI: InChI=1S/C7H3BrFN/c8-6-2-1-5(4-10)7(9)3-6/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 |
| Symbol: | GHS07 |
|---|---|
| CAS: | 105942-08-3 |
| Flash_Point: | 94.0±21.8 °C |
| Product_Name: | 4-Bromo-2-fluorobenzonitrile |
| Bolling_Point: | 231.8±20.0 °C at 760 mmHg |
| FW: | 200.008 |
| Melting_Point: | 69-72 °C |
| MF: | C7H3BrFN |
| Density: | 1.7±0.1 g/cm3 |
| Refractive_Index: | 1.578 |
|---|---|
| Vapor_Pressure: | 0.1±0.5 mmHg at 25°C |
| Flash_Point: | 94.0±21.8 °C |
| LogP: | 2.26 |
| Bolling_Point: | 231.8±20.0 °C at 760 mmHg |
| Water_Solubility: | insoluble |
| PSA: | 23.79000 |
| Molecular_Structure: | ['1. Molar refractive index 3915 ', '2. Molar volume 118 ', '3. Parachor （902K）3114 ', '4. Surface tension 484 ', '5. Dielectric constant N/A ', '6. Polarizability 1552 ', '7. Single isotope mass 198943282 Da ', '8. Nominal mass 199 Da ', '9. Average mass 2000078 Da'] |
| Computational_Chemistry: | ['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :162 ', '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'] |
| Melting_Point: | 69-72 °C |
| MF: | C7H3BrFN |
| Exact_Mass: | 198.943283 |
| FW: | 200.008 |
| Density: | 1.7±0.1 g/cm3 |
| More_Info: | ['1 . Appearance White or 浅棕色结晶性粉末 ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）69-72 ', '5 . Boiling point（ºC,Atmospheric pressure）238-239 ', '6 . Boiling point（ºC，48mmHg）Unknow ', '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 Insoluble in Water '] |
| Symbol: | GHS07 |
|---|---|
| RIDADR: | 3439 |
| HS_Code: | 2926909090 |
| Packing_Group: | III |
| Hazard_Class: | 6.1 |
| Risk_Statements(EU): | R20/21/22;R36/37/38 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard_Codes: | Xn:Harmful |
| Warning_Statement: | P261-P280-P305 + P351 + P338 |
| Safety_Statements: | H302-H312-H315-H319-H332-H335 |
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