4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate
Bezeichnung:4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate
CAS-Nr202189-76-2
Englisch Name:4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate
CBNumberCB93076733
SummenformelC23H29NO4S
Molgewicht415.55
MOL-Datei202189-76-2.mol
4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate physikalisch-chemischer Eigenschaften
| Siedepunkt | 545.1±45.0 °C(Predicted) |
| Dichte | 1.14±0.1 g/cm3(Predicted) |
| Dampfdruck | 0Pa at 25℃ |
| storage temp. | 2-8°C |
| Löslichkeit | soluble in Dichloromethane; |
| pka | 5.78±0.70(Predicted) |
| Wasserlöslichkeit | 5.717μg/L at 25℃ |
| InChI | InChI=1S/C23H29NO4S/c1-17-6-12-20(13-7-17)29(25,26)28-15-14-18-8-10-19(11-9-18)23(4,5)21-24-22(2,3)16-27-21/h6-13H,14-16H2,1-5H3 |
| InChIKey | BGUOPDZOVDIWLE-UHFFFAOYSA-N |
| SMILES | C(C1C=CC(CCOS(C2C=CC(C)=CC=2)(=O)=O)=CC=1)(C1OCC(C)(C)N=1)(C)C |
| LogP | 6.6 |
