Linalyl acetate

Catalog	ACM115957
CAS	115-95-7
Structure
Synonyms	Linalolacetate
IUPAC Name	3,7-Dimethylocta-1,6-dien-3-yl acetate
Molecular Weight	196.29
Molecular Formula	C12H20O2
Canonical SMILES	CC(=CCCC(C)(C=C)OC(=O)C)C
InChI	InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3
InChI Key	UWKAYLJWKGQEPM-UHFFFAOYSA-N
Boiling Point	220 °C(lit.)
Melting Point	85 °C
Flash Point	194 °F
Purity	97%
Density	0.901 g/mL at 25 °C(lit.)
Solubility	Insoluble in water
Appearance	Clear colorless liquid
Storage	-20 °C
Exact Mass	196.146329876
Monoisotopic Mass	196.146329876
Physical State	Liquid
Refractive Index	n20/D 1.453(lit.)
Storage Conditions	-20 °C
Topological Polar Surface Area	26.3 Ų