963-75-7
| Name | Androst-2-en-17-one |
| CAS | 963-75-7 |
| EINECS(EC#) | 242-220-1 |
| Molecular Formula | C19H28O |
| MDL Number | MFCD00010479 |
| Molecular Weight | 272.43 |
| MOL File | 963-75-7.mol |
Chemical Properties
| Melting point | 140-145 °C(lit.) |
| Boiling point | 371.6±42.0 °C(Predicted) |
| density | 1.032±0.06 g/cm3(Predicted) |
| storage temp. | Refrigerator |
| solubility | DMF: 15 mg/ml,DMSO: insol,Ethanol: 10 mg/ml,PBS (pH 7.2): insol |
| form | A solid |
| InChI | InChI=1/C19H28O/c1-18-11-4-3-5-13(18)6-7-14-15-8-9-17(20)19(15,2)12-10-16(14)18/h3-4,13-16H,5-12H2,1-2H3/t13-,14+,15+,16+,18+,19+/s3 |
| InChIKey | ISJVDMWNISUFRJ-LPDARYMINA-N |
| SMILES | C[C@]12CC=CC[C@]1([H])CC[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H] |&1:1,6,10,12,18,22,r| |
| CAS DataBase Reference | 963-75-7(CAS DataBase Reference) |
| NIST Chemistry Reference | Androst-2-en-17-one, (5«alpha»)-(963-75-7) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302+H312+H332 |
| WGK Germany | - |
| REACH Registrations | Active |