Melting point |
139-141 °C |
Boiling point |
427.89°C (rough estimate) |
Density |
1.0234 (rough estimate) |
refractive index |
1.6000 (estimate) |
Flash point |
2℃ |
storage temp. |
Controlled Substance, -20°C Freezer |
solubility |
Acetonitrile: 1 mg/ml; Ethanol: 1 mg/ml; Methanol: 1 mg/ml |
form |
A crystalline solid |
Water Solubility |
2.35mg/L(25 ºC) |
Merck |
13,9255 |
InChI |
InChI=1/C21H30O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h12,16-19H,4-11H2,1-3H3/t16-,17-,18-,19-,20-,21-/s3 |
InChIKey |
DJPZSBANTAQNFN-PXQJOHHUSA-N |
SMILES |
[C@]12([H])CC[C@]3(C)[C@H](CC[C@@]3([H])[C@]1([H])CCC1=CC(=O)CC[C@]21C)OC(=O)C |&1:0,4,6,9,11,21,r| |
CAS DataBase Reference |
1045-69-8(CAS DataBase Reference) |
NIST Chemistry Reference |
Androst-4-en-3-one, 17-(acetyloxy)-, (17«beta»)-(1045-69-8) |