4-(2-Carboxyethyl)benzeneboronic acid
- Product Name4-(2-Carboxyethyl)benzeneboronic acid
- CAS166316-48-9
- MFC9H11BO4
- MW193.99
- EINECS681-349-1
- MOL File166316-48-9.mol
Chemical Properties
| Melting point | 158-160°C |
| Boiling point | 419.2±47.0 °C(Predicted) |
| Density | 1.28±0.1 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| pka | 4.63±0.10(Predicted) |
| form | solid |
| Appearance | White to off-white Solid |
| Water Solubility | Slightly soluble in water. |
| BRN | 9198524 |
| InChI | 1S/C9H11BO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5,13-14H,3,6H2,(H,11,12) |
| InChIKey | VPSARXNVXCRDIV-UHFFFAOYSA-N |
| SMILES | OB(O)c1ccc(CCC(O)=O)cc1 |
| CAS DataBase Reference | 166316-48-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,Xn |
| Risk Statements | 36/37/38-36-22 |
| Safety Statements | 26-36/37/39 |
| WGK Germany | WGK 3 |
| HS Code | 2931900090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Eye Irrit. 2 |
