Diisopropyl Ether
CAS Number: 108-20-3
Molecular Mass: 102.17 g/mol
Formula: C6H14O
Smiles: CC(C)OC(C)C
Melting point: 503.3 °C
Boiling point: 404.4 °C
Density: - g/cm3
Dipole moment: - D
Refractive index: 10.68395
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 122.1357 |
| PMI2 | 326.8390 |
| PMI3 | 369.7607 |
| NPR1 | 0.3303 |
| NPR2 | 0.8839 |
| RadiusOfGyration | 2.0016 |
| InertialShapeFactor | 0.0072 |
| Eccentricity | 0.9439 |
| Asphericity | 0.3135 |
| SpherocityIndex | 0.3909 |
| PBF | 0.7779 |