4-Hydroxyestrone
- Product Name4-Hydroxyestrone
- CAS3131-23-5
- MFC18H22O3
- MW286.37
- EINECS
- MOL File3131-23-5.mol
Chemical Properties
| Melting point | 260-263°C |
| Boiling point | 468.2±45.0 °C(Predicted) |
| Density | 1.241±0.06 g/cm3(Predicted) |
| Flash point | 93 °C |
| storage temp. | −20°C |
| solubility | DMSO (Slightly), Ethanol (Slightly, Sonicated), Methanol (Slightly) |
| form | Solid |
| pka | 10.06±0.40(Predicted) |
| color | Pale Yellow to Light Brown |
| InChI | 1S/C18H22O3/c1-18-9-8-11-10-4-6-15(19)17(21)13(10)3-2-12(11)14(18)5-7-16(18)20/h4,6,11-12,14,19,21H,2-3,5,7-9H2,1H3/t11-,12-,14+,18+/m1/s1 |
| InChIKey | XQZVQQZZOVBNLU-QDTBLXIISA-N |
| SMILES | [H][C@]12CC[C@]3(C)C(=O)CC[C@@]3([H])[C@]1([H])CCc4c(O)c(O)ccc24 |
