3β-Hydroxyandrost-5-en-17-onacetat
Bezeichnung:3β-Hydroxyandrost-5-en-17-onacetat
CAS-Nr853-23-6
Englisch Name:Dehydroepiandrosterone acetate
CBNumberCB0247928
SummenformelC21H30O3
Molgewicht330.47
MOL-Datei853-23-6.mol
Synonyma
3β-Hydroxyandrost-5-en-17-onacetat
3β-Hydroxyandrost-5-en-17-onacetat physikalisch-chemischer Eigenschaften
Schmelzpunkt | 168-170 °C(lit.) |
Siedepunkt | 407.89°C (rough estimate) |
Dichte | 1.0998 (rough estimate) |
Dampfdruck | 0Pa at 20℃ |
Brechungsindex | 1.5192 (estimate) |
storage temp. | Refrigerator |
Löslichkeit | Chloroform, DMSO (Slightly), Methanol (Slightly) |
Aggregatzustand | Solid |
Farbe | White to Off-White |
Optische Aktivität | [α]20/D +2.4°, c = 2 in ethanol |
Wasserlöslichkeit | 11.5mg/L(temperature not stated) |
InChI | InChI=1/C21H30O3/c1-13(22)24-15-8-10-20(2)14(12-15)4-5-16-17-6-7-19(23)21(17,3)11-9-18(16)20/h4,15-18H,5-12H2,1-3H3/t15-,16-,17-,18-,20-,21-/s3 |
InChIKey | NCMZQTLCXHGLOK-KJBVPOJVSA-N |
SMILES | C[C@]12CC[C@H](OC(=O)C)CC1=CC[C@@]1([H])[C@]3([H])CCC(=O)[C@@]3(C)CC[C@]21[H] |&1:1,4,13,15,21,25,r| |
LogP | 5.1 at 20℃ |
CAS Datenbank | 853-23-6 |