2-Nitrobenzeneboronic acid pinacol ester
Catalog No: FT-0643801
CAS No: 190788-59-1
- Chemical Name: 2-Nitrobenzeneboronic acid pinacol ester
- Molecular Formula: C12H16BNO4
- Molecular Weight: 249.07
- InChI Key: VLJYUDGCEKORNG-UHFFFAOYSA-N
- InChI: InChI=1S/C12H16BNO4/c1-11(2)12(3,4)18-13(17-11)9-7-5-6-8-10(9)14(15)16/h5-8H,1-4H3
| 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: | 42-44°C |
|---|---|
| CAS: | 190788-59-1 |
| MF: | C6H6BNO4 |
| Flash_Point: | 180.5±28.4 °C |
| Product_Name: | (2-Nitrophenyl)boronic acid |
| Density: | 1.4±0.1 g/cm3 |
| FW: | 166.927 |
| Bolling_Point: | 374.8±44.0 °C at 760 mmHg |
| Refractive_Index: | 1.574 |
|---|---|
| Vapor_Pressure: | 0.0±0.9 mmHg at 25°C |
| Flash_Point: | 180.5±28.4 °C |
| LogP: | 1.32 |
| Bolling_Point: | 374.8±44.0 °C at 760 mmHg |
| FW: | 166.927 |
| PSA: | 86.28000 |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 643 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :324 ', '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: | 42-44°C |
| MF: | C6H6BNO4 |
| Exact_Mass: | 167.038986 |
| Density: | 1.4±0.1 g/cm3 |
| More_Info: | ['1 . Appearance White Solid ', '2 . Density(g/mL,20 ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)42-44 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC20mmHg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºF)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 不能溶解于Water 的'] |
| Risk_Statements(EU): | R36/37/38 |
|---|---|
| HS_Code: | 2934999090 |
| Safety_Statements: | S26-S36 |
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