(-)-Corey lactone 4-phenylbenzoate alcohol
Bezeichnung:(-)-Corey lactone 4-phenylbenzoate alcohol
CAS-Nr31752-99-5
Englisch Name:(-)-Corey lactone 4-phenylbenzoate alcohol
CBNumberCB0352945
SummenformelC21H20O5
Molgewicht352.38
MOL-Datei31752-99-5.mol
(-)-Corey lactone 4-phenylbenzoate alcohol physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 131-132 °C(lit.) |
| alpha | -89 º (c=1, CHCl3) |
| Siedepunkt | 446°C (rough estimate) |
| Dichte | 1.1818 (rough estimate) |
| Brechungsindex | 1.5400 (estimate) |
| storage temp. | 2-8°C |
| Löslichkeit | Chloroform, Ethyl Acetate |
| Aggregatzustand | Solid |
| pka | 14.79±0.10(Predicted) |
| Farbe | Off-White to Pale Yellow |
| Optische Rotation | [α]20/D 87°, c = 1 in chloroform |
| Wasserlöslichkeit | insoluble |
| BRN | 1294692 |
| InChI | 1S/C21H20O5/c22-12-17-16-10-20(23)25-18(16)11-19(17)26-21(24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16-19,22H,10-12H2/t16-,17-,18+,19-/m1/s1 |
| InChIKey | SZJVIFMPKWMGSX-UHFFFAOYSA-N |
| SMILES | OC[C@H]1[C@@H](C[C@@H]2OC(=O)C[C@H]12)OC(=O)c3ccc(cc3)-c4ccccc4 |
| CAS Datenbank | 31752-99-5(CAS DataBase Reference) |
