CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | clear blue liquid |
|---|---|
| Boiling Point | 152.00 °C. @ 760.00 mm Hg |
| Solubility | insoluble in water; miscible in oil |
| Density | 1.075-1.081 |
| Refractive Index | 1.531-1.541 |
| Kovats Retention Index | 873 880 |
COMPUTED DESCRIPTORS
| Molecular Weight | 108.23 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 108.00674260 g/mol |
| Monoisotopic Mass | 108.00674260 g/mol |
| Topological Polar Surface Area | 2 Ų |
| Heavy Atom Count | 5 |
| Formal Charge | 0 |
| Complexity | 20.9 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |