3,3,4,4,4-Pentafluorobutan-1-ol
- Product Name3,3,4,4,4-Pentafluorobutan-1-ol
- CAS54949-74-5
- MFC4H5F5O
- MW164.07
- EINECS259-405-8
- MOL File54949-74-5.mol
Chemical Properties
| Boiling point | 83-85°C |
| Density | 1.374±0.06 g/cm3(Predicted) |
| refractive index | 1.315 |
| solubility | DMSO (Sparingly), Methanol (Slightly) |
| form | liquid |
| pka | 14.11±0.10(Predicted) |
| color | Clear |
| Henry's Law Constant | 5.1×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
| InChI | 1S/C4H5F5O/c5-3(6,1-2-10)4(7,8)9/h10H,1-2H2 |
| InChIKey | JPMHUDBOKDBBLG-UHFFFAOYSA-N |
| SMILES | FC(CCO)(F)C(F)(F)F |
| EPA Substance Registry System | 1-Butanol, 3,3,4,4,4-pentafluoro- (54949-74-5) |
Safety Information
| Hazard Codes | F |
| Risk Statements | 10 |
| Safety Statements | 16 |
| RIDADR | 1987 |
| TSCA | TSCA listed |
| HazardClass | FLAMMABLE |
| HS Code | 2905599890 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |