FRAXINELLONE
- Product NameFRAXINELLONE
- CAS28808-62-0
- MFC14H16O3
- MW232.27
- EINECS
- MOL File28808-62-0.mol
Chemical Properties
| Melting point | 114.0 to 118.0 °C |
| Boiling point | 314.44°C (rough estimate) |
| Density | 1.1649 (rough estimate) |
| refractive index | 1.5557 (estimate) |
| storage temp. | Keep in dark place,Sealed in dry,Store in freezer, under -20°C |
| solubility | Soluble in acetone and methan |
| form | powder to crystal |
| color | White to Almost white |
| Major Application | food and beverages |
| InChI | 1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m0/s1 |
| InChIKey | XYYAFLHHHZVPRN-GXTWGEPZSA-N |
| SMILES | CC1=C(C(O[C@H]2C3=COC=C3)=O)[C@@]2(C)CCC1 |
Safety Information
| Safety Statements | 24/25 |
| RIDADR | UN 2811 6.1/PG III |
| WGK Germany | WGK 3 |
| RTECS | TI3767000 |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29321900 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Repr. 2 |