CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 633 634 634 633.3 633.7 634 646 |
---|
COMPUTED DESCRIPTORS
Molecular Weight | 86.13 g/mol |
---|---|
XLogP3 | 1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 1 |
Exact Mass | 86.073164938 g/mol |
Monoisotopic Mass | 86.073164938 g/mol |
Topological Polar Surface Area | 12.5 Ų |
Heavy Atom Count | 6 |
Formal Charge | 0 |
Complexity | 61 |
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 |