Product Name
Alpha-Bisabolol
Synonyms
6-Methyl-2-(4-methyl-3-cyclohexen-1-yl)-5-hepteno
IUPAC Name
(2R)-6-Methyl-2-[(1R)-4-methylcyclohex-3-en-1-yl]hept-5-en-2-ol
Canonical SMILES
CC1=CCC(CC1)C(C)(CCC=C(C)C)O
InChI
InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3/t14-,15+/m0/s1
InChI Key
RGZSQWQPBWRIAQ-LSDHHAIUSA-N
Density
0.93 g/mL at 20 °C(lit.)
Solubility
Soluble in alcohol, natural mineral, synthetic oils, insoluble in water
Appearance
Cear colourless liquid
Isomeric SMILES
CC1=CC[C@@H](CC1)[C@@](C)(CCC=C(C)C)O
Monoisotopic Mass
222.198365449
Refractive Index
n20/D 1.496
Stability
Stable. Combustible. Incompatible with strong oxidizing agents.
Storage Conditions
Keep tightly closed. Store in a cool dry place.
Topological Polar Surface Area
20.2 Ų