Mesitylene
CAS Number: 108-67-8
Molecular Mass: 120.19 g/mol
Formula: C9H12
Smiles: Cc1cc(C)cc(C)c1
Melting point: -44.72 °C
Boiling point: 164.7 °C
Density: 0.8637 g/cm3
Dipole moment: 0.047 D
Refractive index: 1.49541
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 288.4178 |
| PMI2 | 288.4181 |
| PMI3 | 567.1517 |
| NPR1 | 0.5085 |
| NPR2 | 0.5085 |
| RadiusOfGyration | 2.1815 |
| InertialShapeFactor | 0.0018 |
| Eccentricity | 0.8610 |
| Asphericity | 0.2375 |
| SpherocityIndex | 0.0884 |
| PBF | 0.2986 |