3-Hydroxyflavone
- Product Name3-Hydroxyflavone
- CAS577-85-5
- MFC15H10O3
- MW238.24
- EINECS209-416-9
- MOL File577-85-5.mol
Chemical Properties
| Melting point | 171-172 °C (lit.) |
| Boiling point | 320.83°C (rough estimate) |
| Density | 1.2653 (rough estimate) |
| refractive index | 1.5740 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | DMSO: 1 mg/ml |
| form | powder to crystal |
| pka | 8.80±0.20(Predicted) |
| color | White to Yellow to Green |
| Water Solubility | Insoluble in water. Soluble in N,N-DMF and ethanol. |
| BRN | 15789 |
| InChI | 1S/C15H10O3/c16-13-11-8-4-5-9-12(11)18-15(14(13)17)10-6-2-1-3-7-10/h1-9,17H |
| InChIKey | HVQAJTFOCKOKIN-UHFFFAOYSA-N |
| SMILES | OC1=C(Oc2ccccc2C1=O)c3ccccc3 |
| LogP | 3.477 (est) |
| CAS DataBase Reference | 577-85-5(CAS DataBase Reference) |
| EPA Substance Registry System | 4H-1-Benzopyran-4-one, 3-hydroxy-2-phenyl- (577-85-5) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-37/39 |
| WGK Germany | 3 |
| RTECS | LK8650000 |
| Hazard Note | Irritant |
| TSCA | TSCA listed |
| HS Code | 29322090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Hazardous Substances Data | 577-85-5(Hazardous Substances Data) |