(3-Cyanomethylphenyl)boronic acid, pinacol ester
- Product Name(3-Cyanomethylphenyl)boronic acid, pinacol ester
- CAS396131-82-1
- MFC14H18BNO2
- MW243.11
- EINECS
- MOL File396131-82-1.mol
Chemical Properties
| Melting point | 44-48°C |
| Boiling point | 379.5±25.0 °C(Predicted) |
| Density | 1.05±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| form | solid |
| color | Beige |
| Water Solubility | Slightly soluble in water. |
| InChI | 1S/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)12-7-5-6-11(10-12)8-9-16/h5-7,10H,8H2,1-4H3 |
| InChIKey | LIWPKYSGWSFPEE-UHFFFAOYSA-N |
| SMILES | B2(OC(C(O2)(C)C)(C)C)c1cc(ccc1)CC#N |
| CAS DataBase Reference | 396131-82-1 |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 20/21/22-36/37/38 |
| Safety Statements | 26-36/37/39 |
| RIDADR | 3439 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2931900090 |
| Storage Class | 11 - Combustible Solids |
