67000-89-9
| Name | 1-PYRENEBUTANOL |
| CAS | 67000-89-9 |
| Molecular Formula | C20H18O |
| MDL Number | MFCD00192423 |
| Molecular Weight | 274.36 |
| MOL File | 67000-89-9.mol |
Chemical Properties
| Melting point | 80-83 °C (lit.) |
| Boiling point | 488.4±24.0 °C(Predicted) |
| density | 1.217±0.06 g/cm3(Predicted) |
| storage temp. | Store at room temperature |
| pka | 15.15±0.10(Predicted) |
| Appearance | White to light yellow Solid |
| InChI | InChI=1S/C20H18O/c21-13-2-1-4-14-7-8-17-10-9-15-5-3-6-16-11-12-18(14)20(17)19(15)16/h3,5-12,21H,1-2,4,13H2 |
| InChIKey | MRENSFROWALQNU-UHFFFAOYSA-N |
| SMILES | C1(CCCCO)=C2C3=C4C(C=C2)=CC=CC4=CC=C3C=C1 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 2907199090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |