4-Bromo-2-methylbenzonitrile
Catalog No: FT-0617790
CAS No: 67832-11-5
- Chemical Name: 4-Bromo-2-methylbenzonitrile
- Molecular Formula: C8H6BrN
- Molecular Weight: 196.04
- InChI Key: LPEBMDFRIKYFCF-UHFFFAOYSA-N
- InChI: InChI=1S/C8H6BrN/c1-6-4-8(9)3-2-7(6)5-10/h2-4H,1H3
| 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: | 67832-11-5 |
| Flash_Point: | 110.4±21.8 °C |
| Product_Name: | 4-Bromo-2-methylbenzonitrile |
| Bolling_Point: | 259.0±20.0 °C at 760 mmHg |
| FW: | 196.044 |
| Melting_Point: | 65-69 °C |
| MF: | C8H6BrN |
| Density: | 1.5±0.1 g/cm3 |
| Refractive_Index: | 1.591 |
|---|---|
| Vapor_Pressure: | 0.0±0.5 mmHg at 25°C |
| Flash_Point: | 110.4±21.8 °C |
| LogP: | 2.88 |
| Bolling_Point: | 259.0±20.0 °C at 760 mmHg |
| Water_Solubility: | insoluble |
| PSA: | 23.79000 |
| Molecular_Structure: | ['1 . Molar refractive index 4366 ', '2 . Molar volume (m3/mol)1292 ', '3 . Parachor (902K)3423 ', '4 . Surface tension 492 ', '5 . Polarizability (10 -24cm 3)1730'] |
| Computational_Chemistry: | ['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '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 :158 ', '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: | 65-69 °C |
| MF: | C8H6BrN |
| Exact_Mass: | 194.968353 |
| FW: | 196.044 |
| Density: | 1.5±0.1 g/cm3 |
| More_Info: | ['1 . Appearance 奶油色粉末。 ', '2 . Density(g/mL,25/4℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)63-68 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)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 不能Soluble 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 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard_Codes: | Xn:Harmful; |
| Warning_Statement: | P305 + P351 + P338 |
| Safety_Statements: | H302-H319 |
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