Table 2.
PubChem CID | 1549992 |
Molecular Formula | C15H26O |
Synonyms | (+)-α-Bisabolol, D-α-Bisabolol, (2R)-6-Methyl-2-(4-methyl-3-cyclohexenyl)-5-heptene-2-ol, Dragosantol, Camilol, Hydagen B, (+)-6R,7R-α-Bisabolol, |
Molecular Weight | 222.37 |
XLogP3-AA | 3.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | Rotatable Bond Count |
Exact Mass | 222.198365449 |
Monoisotopic Mass | 222.198365449 |
Topological Polar Surface Area | 20.2 Å2 |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 284 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Solubility | 1.688 mg/L @ 25 °C (est), Practically insoluble or insoluble in water, slightly soluble in ethanol |
Density | 0.922–0.931 |
LogP | 5.070 (est) |
Refractive Index | 1.491–1.500 |
Food additive class | Flavoring agent |
* Compiled from the PubChem substances.