Isobutylparaben
- Product NameIsobutylparaben
- CAS4247-02-3
- MFC11H14O3
- MW194.23
- EINECS224-208-8
- MOL File4247-02-3.mol
Chemical Properties
| Melting point | 76°C |
| Boiling point | 302.3±15.0 °C(Predicted) |
| Density | 1.105±0.06 g/cm3(Predicted) |
| vapor pressure | 0.001Pa at 20℃ |
| storage temp. | 2-8°C |
| solubility | Chloroform (Slightly), Methanol (Slightly) |
| pka | 8.17±0.15(Predicted) |
| form | Solid |
| color | White |
| Water Solubility | Insoluble in water. |
| BRN | 2642305 |
| InChI | InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8,12H,7H2,1-2H3 |
| InChIKey | XPJVKCRENWUEJH-UHFFFAOYSA-N |
| SMILES | C(OCC(C)C)(=O)C1=CC=C(O)C=C1 |
| LogP | 3.43 at 23℃ |
| CAS DataBase Reference | 4247-02-3(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi,N |
| Risk Statements | 51/53 |
| Safety Statements | 22-24/25-61 |
| RIDADR | UN 3077 9/PG 3 |
| WGK Germany | 2 |
| RTECS | DH2247000 |
| HazardClass | IRRITANT |
| HS Code | 29182900 |
