Zearalenone
- Product NameZearalenone
- CAS17924-92-4
- MFC18H22O5
- MW318.36
- EINECS241-864-0
- MOL File17924-92-4.mol
Chemical Properties
| Melting point | 164-165°C |
| alpha | 25546 -170.5° (c = 1.0 in CH3OH) |
| Boiling point | 377.53°C (rough estimate) |
| Density | 1.1270 (rough estimate) |
| refractive index | 1.6120 (estimate) |
| Flash point | 6 °C |
| storage temp. | 2-8°C |
| solubility | DMF: 30 mg/ml; DMSO: 30 mg/ml; DMSO:PBS (pH 7.2) (1:7): 0.12 mg/ml; Ethanol: 20 mg/ml |
| pka | 7.58±0.40(Predicted) |
| form | Solid |
| color | Off-white |
| Merck | 13,10169 |
| BRN | 1350216 |
| Major Application | cleaning products cosmetics food and beverages personal care |
| InChI | 1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1 |
| InChIKey | MBMQEIFVQACCCH-QBODLPLBSA-N |
| SMILES | OC1=C(C(O[C@@H](C)CCC2)=O)C(/C=C/CCCC2=O)=CC(O)=C1 |
| LogP | 3.830 (est) |
Safety Information
| Hazard Codes | C,Xn,F |
| Risk Statements | 34-62-63-36-20/21/22-11 |
| Safety Statements | 26-36/37/39-45-36-16-36/37 |
| RIDADR | UN 3261 8/PG 2 |
| WGK Germany | 3 |
| RTECS | DM2550000 |
| F | 10 |
| TSCA | TSCA listed |
| HS Code | 29322090 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Eye Irrit. 2 Flam. Liq. 2 |
| Hazardous Substances Data | 17924-92-4(Hazardous Substances Data) |