64546-10-7
| Name | alpha-hydroxyetizolam |
| CAS | 64546-10-7 |
| Molecular Formula | C17H15ClN4OS |
| Molecular Weight | 358.85 |
| MOL File | 64546-10-7.mol |
Chemical Properties
| Boiling point | 595.3±60.0 °C(Predicted) |
| density | 1.51±0.1 g/cm3(Predicted) |
| storage temp. | -20°C |
| solubility | DMF: 15 mg/mL; DMSO: 15 mg/mL; Ethanol: 15 mg/mL; PBS (pH 7.2): 0.5 mg/mL |
| form | A solid |
| pka | 13.52±0.20(Predicted) |
| Major Application | clinical testing |
| InChI | 1S/C17H15ClN4OS/c1-9(23)14-7-11-8-19-15(12-5-3-4-6-13(12)18)16-21-20-10(2)22(16)17(11)24-14/h3-9,15,23H,1-2H3 |
| InChIKey | BTGCWXDWJAGZML-UHFFFAOYSA-N |
| SMILES | [s]1c2c(cc1C(O)C)C=NC(c4[n]2c(nn4)C)c3c(cccc3)Cl |