Bromobenzene
CAS Number: 108-86-1
Molecular Mass: 157.01 g/mol
Formula: C6H5Br
Smiles: Brc1ccccc1
Melting point: -30.72 °C
Boiling point: 156.2 °C
Density: 1.495 g/cm3
Dipole moment: 1.7 D
Refractive index: 1.5602
Molecule 3D descriptors
| Descriptor | Value |
|---|---|
| PMI1 | 89.0159 |
| PMI2 | 513.0978 |
| PMI3 | 602.1137 |
| NPR1 | 0.1478 |
| NPR2 | 0.8522 |
| RadiusOfGyration | 1.9583 |
| InertialShapeFactor | 0.0096 |
| Eccentricity | 0.9890 |
| Asphericity | 0.6221 |
| SpherocityIndex | 0.0000 |
| PBF | 0.0000 |