CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid; [Sigma-Aldrich MSDS] |
---|---|
Vapor Pressure | 0.00129 [mmHg] |
Kovats Retention Index | 1669.6 1686.1 1652 1622 1667 1662 1649 1622 1662 1662 1672 |
Chemical Classes | Other Classes -> Polycyclic Aromatic Hydrocarbons |
COMPUTED DESCRIPTORS
Molecular Weight | 180.24 g/mol |
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XLogP3 | 4.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 0 |
Exact Mass | 180.093900383 g/mol |
Monoisotopic Mass | 180.093900383 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 154 |
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 |