3,5-Dimethyl-1-hexyn-3-ol
- Product Name3,5-Dimethyl-1-hexyn-3-ol
- CAS107-54-0
- MFC8H14O
- MW126.2
- EINECS203-500-9
- MOL File107-54-0.mol
Chemical Properties
| Melting point | -39°C (estimate) |
| Boiling point | 150-151 °C (lit.) |
| Density | 0.859 g/mL at 25 °C (lit.) |
| vapor density | 4.34 (vs air) |
| vapor pressure | 4.5 mm Hg ( 20 °C) |
| refractive index | n |
| Flash point | 112 °F |
| storage temp. | Flammables area |
| solubility | soluble in Chloroform, Ethyl Acetate |
| form | clear liquid |
| pka | 13.34±0.29(Predicted) |
| Specific Gravity | 0.854 (20/4℃) |
| color | Colorless to Light yellow to Light orange |
| Odor | camphor-like odor |
| Water Solubility | 11.6g/L at 20℃ |
| InChI | 1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3 |
| InChIKey | NECRQCBKTGZNMH-UHFFFAOYSA-N |
| SMILES | CC(C)CC(C)(O)C#C |
Safety Information
| Hazard Codes | T |
| Risk Statements | 10-23/24/25-36 |
| Safety Statements | 16-26-36/37/39-45 |
| RIDADR | UN 1986 3/PG 3 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HazardClass | 3.2 |
| PackingGroup | III |
| HS Code | 29052900 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Inhalation Acute Tox. 3 Oral Eye Irrit. 2 Flam. Liq. 3 |
