3-α-Hydroxy-7-oxo-5-β-cholan-24-sure
Bezeichnung:3-α-Hydroxy-7-oxo-5-β-cholan-24-sure
CAS-Nr4651-67-6
Englisch Name:3alpha-Hydroxy-7-oxo-5beta-cholanic Acid
CBNumberCB2430908
SummenformelC24H38O4
Molgewicht390.56
MOL-Datei4651-67-6.mol
Synonyma
3-α-Hydroxy-7-oxo-5-β-cholan-24-sure
3-α-Hydroxy-7-oxo-5-β-cholan-24-sure physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 205°C |
| Siedepunkt | 545.9±25.0 °C(Predicted) |
| Dichte | 1.124±0.06 g/cm3(Predicted) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | Dioxane (Slightly), DMSO (Slightly), Methanol (Slightly) |
| pka | 4.76±0.10(Predicted) |
| Aggregatzustand | Solid |
| Farbe | White to Off-White |
| Wasserlöslichkeit | 2.062mg/L at 25℃ |
| InChIKey | DXOCDBGWDZAYRQ-QHVQYUNXNA-N |
| SMILES | C(O)(=O)CC[C@H]([C@@H]1[C@@]2(C)CC[C@]3([H])[C@@]4(C)CC[C@@H](O)C[C@@]4([H])CC(=O)[C@@]3([H])[C@]2([H])CC1)C |&1:5,6,7,11,13,17,20,25,27,r| |
| LogP | 3.48 at 20℃ |
