CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Melting point = 34 deg C; [ChemIDplus] |
|---|---|
| Kovats Retention Index | 2135 2103 2135 2103 |
| Chemical Classes | Plastics & Rubber -> Phthalate Esters |
COMPUTED DESCRIPTORS
| Molecular Weight | 310.34 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 12 |
| Exact Mass | 310.14163842 g/mol |
| Monoisotopic Mass | 310.14163842 g/mol |
| Topological Polar Surface Area | 71.1 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 299 |
| 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 |