CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | COLOURLESS-TO-PALE YELLOW OILY LIQUID WITH CHARACTERISTIC ODOUR. |
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Boiling Point | at 0.07kPa: 93 °C |
Solubility | Solubility in water, g/100ml at 20 °C: 0.03 |
Density | Relative density (water = 1): 1.2 |
Vapor Density | Relative vapor density (air = 1): 7.9 |
Vapor Pressure | Vapor pressure, Pa at 20 °C: 0.025 |
COMPUTED DESCRIPTORS
Molecular Weight | 230.3 g/mol |
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XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 7 |
Exact Mass | 230.02002368 g/mol |
Monoisotopic Mass | 230.02002368 g/mol |
Topological Polar Surface Area | 85.1 Ų |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 146 |
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 |