Sandacanol

Catalog	ACM28219616
CAS	28219-61-6
Structure
Synonyms	Ethyl trimethylcyclopentene butenol
IUPAC Name	(E)-2-Ethyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-en-1-ol
Molecular Weight	208.34
Molecular Formula	C14H24O
Canonical SMILES	CCC(=CCC1CC=C(C1(C)C)C)CO
InChI	InChI=1S/C14H24O/c1-5-12(10-15)7-9-13-8-6-11(2)14(13,3)4/h6-7,13,15H,5,8-10H2,1-4H3/b12-7+
InChI Key	KHQDWCKZXLWDNM-KPKJPENVSA-N
Boiling Point	114-116 °C
Purity	99%+
Density	0.91 g/mL at 25 °C(lit.)
Exact Mass	208.182715385
Isomeric SMILES	CC/C(=C\CC1CC=C(C1(C)C)C)/CO
Monoisotopic Mass	208.182715385
Physical State	Liquid
Refractive Index	n20/D 1.4865-1.4885(lit.)
Storage Conditions	-20 °C
Topological Polar Surface Area	20.2 Ų