3-Bromo-4-isopropoxy-5-methoxybenzonitrile
Catalog No: FT-0679455
CAS No: 515848-62-1
- Chemical Name: 3-Bromo-4-isopropoxy-5-methoxybenzonitrile
- Molecular Formula: C11H12BrNO2
- Molecular Weight: 270.12
- InChI Key: DNCFZWKSHFLLGT-UHFFFAOYSA-N
- InChI: InChI=1S/C11H12BrNO2/c1-7(2)15-11-9(12)4-8(6-13)5-10(11)14-3/h4-5,7H,1-3H3
| 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-Bromo-4-isopropoxy-5-methoxybenzonitrile |
|---|---|
| Flash_Point: | 144.6ºC |
| Melting_Point: | N/A |
| FW: | 270.12200 |
| Density: | 1.41g/cm3 |
| CAS: | 515848-62-1 |
| Bolling_Point: | 315.5ºC at 760 mmHg |
| MF: | C11H12BrNO2 |
| Density: | 1.41g/cm3 |
|---|---|
| Computational_Chemistry: | ['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 422 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :248 ', '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: | 3.11658 |
| Flash_Point: | 144.6ºC |
| Refractive_Index: | 1.55 |
| FW: | 270.12200 |
| PSA: | 42.25000 |
| MF: | C11H12BrNO2 |
| Bolling_Point: | 315.5ºC at 760 mmHg |
| Exact_Mass: | 269.00500 |
| Hazard_Class: | 6.1 |
|---|---|
| RIDADR: | UN3439 |
| HS_Code: | 2926909090 |
| Packing_Group: | III |