4-Methyl-1-pentanol
- Product Name4-Methyl-1-pentanol
- CAS626-89-1
- MFC6H14O
- MW102.17
- EINECS210-969-3
- MOL File626-89-1.mol
Chemical Properties
| Melting point | -48.42°C (estimate) |
| Boiling point | 151.9 °C (305.4 °F; 425.0 K) |
| Density | 0.8131 g/cm3 at 20 °C |
| refractive index | 1.42 |
| Flash point | 57 °C |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMF: 50 mg/mL; DMSO: 50 mg/mL; Ethanol: 50 mg/mL; PBS (pH 7.2): 1.4 mg/mL |
| form | liquid |
| pka | 15.21±0.10(Predicted) |
| color | colorless |
| Odor | nutty |
| Water Solubility | 10.42g/L(20 ºC) |
| BRN | 1731303 |
| InChI | 1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3 |
| InChIKey | PCWGTDULNUVNBN-UHFFFAOYSA-N |
| SMILES | CC(C)CCCO |
| LogP | 1.702 (est) |
| CAS DataBase Reference | 626-89-1(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 10-37 |
| Safety Statements | 24/25-16 |
| RIDADR | UN 1987 3/PG 3 |
| WGK Germany | 3 |
| RTECS | NR3020000 |
| HS Code | 2905199090 |
| HazardClass | 3.2 |
| PackingGroup | III |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Flam. Liq. 3 |
