4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate
- Product Name4-(2-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)propan-2-yl)phenethyl 4-methylbenzenesulfonate
- CAS202189-76-2
- MFC23H29NO4S
- MW415.55
- EINECS606-467-2
- MOL File202189-76-2.mol
Chemical Properties
Boiling point | 545.1±45.0 °C(Predicted) |
Density | 1.14±0.1 g/cm3(Predicted) |
vapor pressure | 0Pa at 25℃ |
storage temp. | 2-8°C |
solubility | soluble in Dichloromethane; |
pka | 5.78±0.70(Predicted) |
Water Solubility | 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 |