CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
---|---|
Boiling Point | 142.00 °C. @ 5.00 mm Hg |
Melting Point | 38 - 40 °C |
Solubility | very slightly |
Kovats Retention Index | 1473 |
COMPUTED DESCRIPTORS
Molecular Weight | 228.33 g/mol |
---|---|
XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 228.17254462 g/mol |
Monoisotopic Mass | 228.17254462 g/mol |
Topological Polar Surface Area | 46.5 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 237 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 3 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |