CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless liquid |
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Solubility | insoluble in water; soluble in fats and alcohols |
Density | 1.028-1.035 |
Refractive Index | 1.456-1.462 |
Kovats Retention Index | 1225 |
COMPUTED DESCRIPTORS
Molecular Weight | 132.23 g/mol |
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XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 132.06088618 g/mol |
Monoisotopic Mass | 132.06088618 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 8 |
Formal Charge | 0 |
Complexity | 80.6 |
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 |