epsilon-CAPROLACTONE
CAS Number: 502-44-3
Molecular Mass: 114.14 g/mol
Formula: C6H10O2
Smiles: O=C1CCCCCO1
Melting point: -1.5 °C
Boiling point: 237.0 °C
Density: - g/cm3
Dipole moment: - D
Refractive index: -
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 165.0252 |
| PMI2 | 252.9864 |
| PMI3 | 345.1939 |
| NPR1 | 0.4781 |
| NPR2 | 0.7329 |
| RadiusOfGyration | 1.8284 |
| InertialShapeFactor | 0.0044 |
| Eccentricity | 0.8783 |
| Asphericity | 0.1672 |
| SpherocityIndex | 0.4917 |
| PBF | 0.7109 |