CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless to slightly yellow liquid/light, fresh, rose-like odour |
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Solubility | soluble in alcohol, most fixed oils; insoluble in glycerol, propylene glycol, water |
Density | 0.895-0.908 |
Refractive Index | 1.450-1.458 |
Kovats Retention Index | 1266 |
COMPUTED DESCRIPTORS
Molecular Weight | 198.30 g/mol |
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XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 8 |
Exact Mass | 198.161979940 g/mol |
Monoisotopic Mass | 198.161979940 g/mol |
Topological Polar Surface Area | 26.3 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 185 |
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 |