1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID
- Product Name1-(PHENYLSULFONYL)-1H-INDOL-3-YLBORONIC ACID
- CAS129271-98-3
- MFC14H12BNO4S
- MW301.13
- EINECS
- MOL File129271-98-3.mol
Chemical Properties
| Melting point | 144 °C (dec.)(lit.) |
| Boiling point | 581.4±60.0 °C(Predicted) |
| Density | 1.34±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 7.98±0.30(Predicted) |
| form | powder |
| color | Off-white to pale pink |
| InChI | 1S/C14H12BNO4S/c17-15(18)13-10-16(14-9-5-4-8-12(13)14)21(19,20)11-6-2-1-3-7-11/h1-10,17-18H |
| InChIKey | YKTZLHLBQGCFQX-UHFFFAOYSA-N |
| SMILES | OB(O)c1cn(c2ccccc12)S(=O)(=O)c3ccccc3 |
| CAS DataBase Reference | 129271-98-3(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 24/25-36-26 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| HS Code | 2933299090 |
| Storage Class | 11 - Combustible Solids |