Dimethyl Isosorbide
CAS Number: 5306-85-4
Molecular Mass: 174.19 g/mol
Formula: C8H14O4
Smiles: COCC1OC2OCCC2C1OC
Melting point: - °C
Boiling point: - °C
Density: - g/cm3
Dipole moment: - D
Refractive index: -
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 459.3159 |
| PMI2 | 919.1055 |
| PMI3 | 1231.2289 |
| NPR1 | 0.3731 |
| NPR2 | 0.7465 |
| RadiusOfGyration | 2.6329 |
| InertialShapeFactor | 0.0016 |
| Eccentricity | 0.9278 |
| Asphericity | 0.2657 |
| SpherocityIndex | 0.2415 |
| PBF | 0.7132 |