2-Methyl-5-((1S,2S,4R)-2-methyl-3-methylenebicyclo[2.2.1]heptan-2-yl)pent-2-en-1-ol

CAS	11031-45-1
Structure
Synonyms	β-Santalol
IUPAC Name	(E)-2-Methyl-5-[(1S,2S,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol
Molecular Weight	220.35
Canonical SMILES	CC(=CCCC1(C2CCC(C2)C1=C)C)CO
InChI	InChI=1S/C15H24O/c1-11(10-16)5-4-8-15(3)12(2)13-6-7-14(15)9-13/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5+/t13-,14+,15-/m1/s1
InChI Key	OJYKYCDSGQGTRJ-INLOORNJSA-N
Boiling Point	101-103 °C
Purity	95%+
Density	0.968 g/mL at 25 °C(lit.)
Solubility	Insoluble in water; soluble in oils; poorly soluble in propylene glycol and glycerin
Exact Mass	220.182715385
Isomeric SMILES	C/C(=C\CC[C@]1([C@H]2CC[C@H](C2)C1=C)C)/CO
Monoisotopic Mass	220.182715385
Odor	Very rich, warm-woody, sweet odor
Physical State	Viscous liquid
Refractive Index	n20/D 1.507(lit.)
Storage Conditions	-20 °C
Topological Polar Surface Area	20.2 Ų