HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Androst-5-en-(3β,17β)-diyldiacetat
Androstenediol diacetate · androst-5-ene-3a,17β-diol · ANDROSTENDIOL 3,17-DIACETATE · Androstenediol 3,17-diacetat · 3β,17β-Diacetoxyandrosta-5-ene · Androsta-5-ene-3β,17β-diol diacetate · DELTA-5-ANDROSTENE-3,17-DIOL DIACETATE · Androst-5-ene-3β,17β-diol 3,17-diacetate
Identifikatoren & physikalische Daten
| CAS No. | 2099-26-5 |
|---|---|
| Summenformel | C23H34O4 |
| Durchschnittliche Molmasse | 374,5 g/mol |
| Monoisotopische Masse | 374,24570957 g/mol |
| SMILES | CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H](OC(C)=O)[C@@]4(C)CC[C@@H]32)C1 |
| InChIKey | QXKRUGDXPWHXHL-FQJIPJFPSA-N |
| PubChem CID | 102205 |
| EC No. | 218-264-2 |
| DTXSID | DTXSID10943297 |
| Lokaler Name | Androst-5-en-(3β,17β)-diyldiacetat |
Chemische & physikalische Eigenschaften
| XLogP | 4,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 52,6 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 4 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 27 |
| Formalladung | 0 |
| Komplexität | 667 |
| SpringerMaterials Properties | Chemical shift |
| Endocrine Disruptors | Potential endocrine disrupting compound |
| Schmelzpunkt | 165-166° |
| Siedepunkt | 448.9±45.0 °C(Predicted) |
| Dichte | 1.12±0.1 g/cm3(Predicted) |
| Löslichkeit | Chloroform (Slightly), Ethanol (Slightly) |
| Aggregatzustand | Solid |
| Farbe | White to Off-White |