Octanenitrile
- Product NameOctanenitrile
- CAS124-12-9
- MFC8H15N
- MW125.21
- EINECS204-682-2
- MOL File124-12-9.mol
Chemical Properties
| Melting point | −45 °C(lit.) |
| Boiling point | 198-200 °C(lit.) |
| Density | 0.814 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point | 165 °F |
| form | clear liquid |
| color | Colorless to Light yellow to Light orange |
| Odor | at 10.00 % in dipropylene glycol. fatty aldehydic green |
| Odor Type | aldehydic |
| BRN | 1744063 |
| Henry's Law Constant | 5.7×10-2 mol/(m3Pa) at 25℃, Plyasunov et al. (2006) |
| Dielectric constant | 13.9(25℃) |
| InChI | InChI=1S/C8H15N/c1-2-3-4-5-6-7-8-9/h2-7H2,1H3 |
| InChIKey | YSIMAPNUZAVQER-UHFFFAOYSA-N |
| SMILES | C(#N)CCCCCCC |
| LogP | 2.750 |
| CAS DataBase Reference | 124-12-9(CAS DataBase Reference) |
| EPA Substance Registry System | Octanenitrile (124-12-9) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22 |
| Safety Statements | 36/37 |
| RIDADR | 3276 |
| WGK Germany | 2 |
| RTECS | RG9700300 |
| TSCA | TSCA listed |
| HS Code | 2926.90.5050 |
| HazardClass | 6.1(b) |
| PackingGroup | III |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Oral Skin Irrit. 2 |
| Toxicity | LD50 orl-mus: 1764 mg/kg ARTODN 55,47,84 |