4-[5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl -piperazine-1-carboxylic acid tert-butyl ester
Catalog No: FT-0677598
CAS No: 496786-98-2
- Chemical Name: 4-[5-(4,4,5,5-Tetramethyl-[1,3,2]dioxaborolan-2-yl -piperazine-1-carboxylic acid tert-butyl ester
- Molecular Formula: C20H32BN3O4
- Molecular Weight: 389.3
- InChI Key: JWUBVPJWWYYRLJ-UHFFFAOYSA-N
- InChI: InChI=1S/C20H32BN3O4/c1-18(2,3)26-17(25)24-12-10-23(11-13-24)16-9-8-15(14-22-16)21-27-19(4,5)20(6,7)28-21/h8-9,14H,10-13H2,1-7H3
| 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 |
| Melting_Point: | 165-169 °C |
|---|---|
| CAS: | 496786-98-2 |
| MF: | C20H32BN3O4 |
| Flash_Point: | 265.8±30.1 °C |
| Product_Name: | 6-(4-Boc-1-piperazinyl)pyridine-3-boronic acid pinacol ester |
| Density: | 1.1±0.1 g/cm3 |
| FW: | 389.297 |
| Bolling_Point: | 515.9±50.0 °C at 760 mmHg |
| Refractive_Index: | 1.536 |
|---|---|
| Vapor_Pressure: | 0.0±1.3 mmHg at 25°C |
| Flash_Point: | 265.8±30.1 °C |
| LogP: | 2.44080 |
| Bolling_Point: | 515.9±50.0 °C at 760 mmHg |
| FW: | 389.297 |
| PSA: | 64.13000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 641 ', '7. Heavy Atom Count :28 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :554 ', '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: | 165-169 °C |
| MF: | C20H32BN3O4 |
| Exact_Mass: | 389.248596 |
| Density: | 1.1±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Solid ', '2 . Density(g/mL20 ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)165-169 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC035mmHg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(º F)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,)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(正Octanol /Water )Logarithmic Value of Distribution Coefficient 3,451 ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow'] |
| Hazard_Codes: | Xi |
|---|---|
| HS_Code: | 2934999090 |
| Safety_Statements: | S22-S24/25 |
| WGK_Germany: | 3 |
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