CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 158.4 Ų [M-H]- |
---|---|
Kovats Retention Index | 2052 |
COMPUTED DESCRIPTORS
Molecular Weight | 273.5 g/mol |
---|---|
XLogP3 | 5.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 1 |
Exact Mass | 271.956248 g/mol |
Monoisotopic Mass | 271.956248 g/mol |
Topological Polar Surface Area | 20.2 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 236 |
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 |