Propyl ether
CAS Number: 111-43-3
Molecular Mass: 102.17 g/mol
Formula: C6H14O
Smiles: CCCOCCC
Melting point: -122.0 °C
Boiling point: -1.0 °C
Density: - g/cm3
Dipole moment: - D
Refractive index: 10.69035
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 63.3972 |
| PMI2 | 542.9675 |
| PMI3 | 573.9358 |
| NPR1 | 0.1105 |
| NPR2 | 0.9460 |
| RadiusOfGyration | 2.4033 |
| InertialShapeFactor | 0.0149 |
| Eccentricity | 0.9939 |
| Asphericity | 0.7058 |
| SpherocityIndex | 0.1947 |
| PBF | 0.5244 |