CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colourless to pale yellow liquid; Spicy, sweet aroma |
|---|---|
| Solubility | Insoluble in water |
| Density | 1.095-1.103 |
| Refractive Index | 1.467-1.473 |
COMPUTED DESCRIPTORS
| Molecular Weight | 198.22 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 198.08920892 g/mol |
| Monoisotopic Mass | 198.08920892 g/mol |
| Topological Polar Surface Area | 52.6 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 291 |
| 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 |