2-(beta-Cyanoethyl)cyclohexanone
- Product Name2-(beta-Cyanoethyl)cyclohexanone
- CAS4594-78-9
- MFC9H13NO
- MW151.21
- EINECS224-991-6
- MOL File4594-78-9.mol
Chemical Properties
| Melting point | 61-62 °C |
| Boiling point | 138-142 °C (10 mmHg) |
| Density | 1.024 g/mL at 20 °C(lit.) |
| refractive index | n |
| Flash point | 113℃ |
| storage temp. | 2-8°C |
| Appearance | Colorless to light yellow Liquid |
| InChI | 1S/C9H13NO/c10-7-3-5-8-4-1-2-6-9(8)11/h8H,1-6H2 |
| InChIKey | SPTVCXKSSRBTMN-UHFFFAOYSA-N |
| SMILES | O=C1CCCCC1CCC#N |
| CAS DataBase Reference | 4594-78-9(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn |
| Risk Statements | 20/21/22 |
| Safety Statements | 36 |
| RIDADR | UN3276 |
| WGK Germany | 3 |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral |
