6-Methyl-3-heptanol
- Product Name6-Methyl-3-heptanol
- CAS18720-66-6
- MFC8H18O
- MW130.23
- EINECS242-532-8
- MOL File18720-66-6.mol
Chemical Properties
| Melting point | -61 °C |
| Boiling point | 169 °C |
| Density | 0.82 |
| refractive index | 1.3995 (estimate) |
| Flash point | 38 °C |
| pka | 15.28±0.20(Predicted) |
| form | solid |
| Odor | Oily-floral but rather harsh and unnatural odor of poor tenacity |
| Water Solubility | Very slightly soluble in water |
| Henry's Law Constant | 8.8×10-2 mol/(m3Pa) at 25℃, Yaws (2003) |
| InChI | 1S/C8H18O/c1-4-8(9)6-5-7(2)3/h7-9H,4-6H2,1-3H3 |
| InChIKey | MNBIBGDICHMQFN-UHFFFAOYSA-N |
| SMILES | CCC(O)CCC(C)C |
| LogP | 2.565 (est) |
| CAS DataBase Reference | 18720-66-6 |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36 |
| Safety Statements | 26 |
| WGK Germany | WGK 3 |
| HS Code | 2905190098 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 |
