![3-Bromo-1H-pyrazolo[3,4-b]pyridine (CAS: 68618-36-0) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0684696.png "3-Bromo-1H-pyrazolo[3,4-b]pyridine chemical structure")
3-Bromo-1H-pyrazolo[3,4-b]pyridine
Catalog No: FT-0684696
CAS No: 68618-36-0
- Chemical Name: 3-Bromo-1H-pyrazolo[3,4-b]pyridine
- Molecular Formula: C6H4BrN3
- Molecular Weight: 198.02
- InChI Key: ZGHQNXGPKYUHJW-UHFFFAOYSA-N
- InChI: InChI=1S/C6H4BrN3/c7-5-4-2-1-3-8-6(4)10-9-5/h1-3H,(H,8,9,10)
| 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: | Danger |
|---|---|
| FW: | 198.020 |
| Density: | 1.9±0.1 g/cm3 |
| CAS: | 68618-36-0 |
| Bolling_Point: | 356.2±22.0 °C at 760 mmHg |
| Product_Name: | 3-bromo-1H-pyrazolo[3,4-b]pyridine |
| Melting_Point: | N/A |
| Flash_Point: | 169.2±22.3 °C |
| MF: | C6H4BrN3 |
| Molecular_Structure: | ['1 . Molar refractive index 4240 ', '2 . Molar volume 1045 ', '3 . Parachor （902K）3095 ', '4 . Surface tension 769 ', '5 . Polarizability 1680'] |
|---|---|
| LogP: | 1.73 |
| Flash_Point: | 169.2±22.3 °C |
| Refractive_Index: | 1.746 |
| FW: | 198.020 |
| Density: | 1.9±0.1 g/cm3 |
| Bolling_Point: | 356.2±22.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :3 ', '6. TPSA 416 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :130 ', '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: | 41.57000 |
| MF: | C6H4BrN3 |
| More_Info: | ['1. Melting point（760 mmHg,ºC）165-166'] |
| Vapor_Pressure: | 0.0±0.8 mmHg at 25°C |
| Exact_Mass: | 196.958847 |
| Warning_Statement: | P301 + P310 |
|---|---|
| Safety_Statements: | H301 |
| Symbol: | Danger |
| RIDADR: | UN 2811 6.1 / PGIII |
| HS_Code: | 2933990090 |
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