Product Name
(-)-Verbenone
Category
Heterocyclic Organic Compound
Synonyms
(1S,5S)-Verbenone
IUPAC Name
(1S,5S)-4,6,6-Trimethylbicyclo[3.1.1]hept-3-en-2-one
Canonical SMILES
CC1=CC(=O)C2CC1C2(C)C
InChI
InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m0/s1
InChI Key
DCSCXTJOXBUFGB-JGVFFNPUSA-N
Boiling Point
227-228 °C(lit.)
Density
0.975 g/mL at 20 °C(lit.)
Solubility
Practically insoluble in water, soluble in non-polar solvents
Appearance
Clear light yellow to yellow liquid
Application
(-)-Verbenone is an important component of the essential oil from rosemary. It is also an insect pheromone with a spicy odor and camphoraceous fragrance.
Isomeric SMILES
CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C
Monoisotopic Mass
150.104465066
Refractive Index
n20/D 1.496(lit.)
Topological Polar Surface Area
17.1 Ų