Estradiol benzoate
- Product NameEstradiol benzoate
- CAS50-50-0
- MFC25H28O3
- MW376.5
- EINECS200-043-7
- MOL File50-50-0.mol
Chemical Properties
| Melting point | 191-198 °C(lit.) |
| alpha | D25 +58 to +63° (c = 2 in dioxane) |
| Boiling point | 465.03°C (rough estimate) |
| Density | 1.0493 (rough estimate) |
| refractive index | 1.5460 (estimate) |
| storage temp. | 2-8°C |
| solubility | Practically insoluble in water, freely soluble in methylene chloride, sparingly soluble in acetone, slightly soluble in methanol. |
| form | Solid |
| pka | 15.06±0.40(Predicted) |
| color | White |
| Water Solubility | 0.4mg/L(25 ºC) |
| Merck | 3703 |
| BRN | 3107526 |
| InChIKey | UYIFTLBWAOGQBI-BZDYCCQFSA-N |
| SMILES | [H][C@]12CC[C@]3(C)[C@@H](O)CC[C@@]3([H])[C@]1([H])CCc4cc(OC(=O)c5ccccc5)ccc24 |
| CAS DataBase Reference | 50-50-0(CAS DataBase Reference) |
| NIST Chemistry Reference | Estradiol benzoate(50-50-0) |
Safety Information
| Hazard Codes | T |
| Risk Statements | 60-61-40 |
| Safety Statements | 53-22-36/37/39-45 |
| WGK Germany | 3 |
| RTECS | KG4050000 |
| F | 8 |
| HS Code | 29372319 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Carc. 2 Repr. 1B |
