2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER
- Product Name2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER
- CAS948592-80-1
- MFC13H20BNO2
- MW233.11
- EINECS
- MOL File948592-80-1.mol
Chemical Properties
| Melting point | 82-85°C |
| Boiling point | 355.7±35.0 °C(Predicted) |
| Density | 1.03±0.1 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | 4.33±0.10(Predicted) |
| color | White to Off-White |
| InChI | 1S/C13H20BNO2/c1-9-6-7-11(15)10(8-9)14-16-12(2,3)13(4,5)17-14/h6-8H,15H2,1-5H3 |
| InChIKey | LOOBNTHIWCHTCR-UHFFFAOYSA-N |
| SMILES | B2(OC(C(O2)(C)C)(C)C)c1c(ccc(c1)C)N |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 22 |
| WGK Germany | 3 |
| HS Code | 2931900090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |