COMPUTED DESCRIPTORS
| Molecular Weight | 111.11 g/mol |
|---|---|
| XLogP3 | -1.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 111.05449518 g/mol |
| Monoisotopic Mass | 111.05449518 g/mol |
| Topological Polar Surface Area | 91.4 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 99.8 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |