CHEMICAL AND PHYSICAL PROPERTIES
Kovats Retention Index | 1577.3 1592 |
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COMPUTED DESCRIPTORS
Molecular Weight | 185.26 g/mol |
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XLogP3 | 3.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 2 |
Exact Mass | 185.120449483 g/mol |
Monoisotopic Mass | 185.120449483 g/mol |
Topological Polar Surface Area | 12.9 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 178 |
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 |