2-Pentanol
CAS Number: 6032-29-7
Molecular Mass: 88.15 g/mol
Formula: C5H12O
Smiles: CCCC(C)O
Melting point: -73.0 °C
Boiling point: 404.4 °C
Density: - g/cm3
Dipole moment: - D
Refractive index: 1.403
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 69.2862 |
| PMI2 | 290.6495 |
| PMI3 | 334.1692 |
| NPR1 | 0.2073 |
| NPR2 | 0.8698 |
| RadiusOfGyration | 1.9842 |
| InertialShapeFactor | 0.0126 |
| Eccentricity | 0.9783 |
| Asphericity | 0.5025 |
| SpherocityIndex | 0.2554 |
| PBF | 0.5508 |