Butyl ether
CAS Number: 142-96-1
Molecular Mass: 130.23 g/mol
Formula: C8H18O
Smiles: CCCCOCCCC
Melting point: 495.6 °C
Boiling point: 404.4 °C
Density: - g/cm3
Dipole moment: - D
Refractive index: 10.6996
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 144.0214 |
| PMI2 | 998.2477 |
| PMI3 | 1075.1345 |
| NPR1 | 0.1340 |
| NPR2 | 0.9285 |
| RadiusOfGyration | 2.9178 |
| InertialShapeFactor | 0.0064 |
| Eccentricity | 0.9910 |
| Asphericity | 0.6519 |
| SpherocityIndex | 0.1662 |
| PBF | 0.6627 |