CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear colourless to yellow liquid; Sweet wine-like aroma with fruity green notes |
|---|---|
| Solubility | Soluble in water |
| Density | 0.934-0.994 |
| Refractive Index | 1.413-1.433 |
| Kovats Retention Index | 1365 1365 |
COMPUTED DESCRIPTORS
| Molecular Weight | 216.27 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 9 |
| Exact Mass | 216.13615911 g/mol |
| Monoisotopic Mass | 216.13615911 g/mol |
| Topological Polar Surface Area | 52.6 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 201 |
| 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 |