(-)-CITRONELLAL
- Product Name(-)-CITRONELLAL
- CAS5949-05-3
- MFC10H18O
- MW154.25
- EINECS227-707-9
- MOL File5949-05-3.mol
Chemical Properties
| Boiling point | 227.64°C (estimate) |
| Density | 0.851 g/mL at 20 °C (lit.) |
| refractive index | n |
| Flash point | 168 °F |
| storage temp. | Hygroscopic, Refrigerator, under inert atmosphere |
| solubility | Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly) |
| form | Oil |
| color | Colourless |
| Odor | at 10.00 % in dipropylene glycol. clean herbal citrus |
| Odor Type | citrus |
| optical activity | [α]20/D 15°, neat |
| BRN | 1720790 |
| InChI | 1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m0/s1 |
| InChIKey | NEHNMFOYXAPHSD-JTQLQIEISA-N |
| SMILES | [H]C(=O)C[C@@H](C)CC\C=C(\C)C |
| LogP | 3.482 (est) |
| CAS DataBase Reference | 5949-05-3(CAS DataBase Reference) |
| EPA Substance Registry System | 6-Octenal, 3,7-dimethyl-, (3S)- (5949-05-3) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| F | 10-23 |
| TSCA | TSCA listed |
| HS Code | 29121900 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
