Citronellyl butyrate

Catalog	ACM141162
CAS	141-16-2
Structure
Synonyms	2,6-Dimethyl-2-octen-8-yl butyrate
IUPAC Name	3,7-Dimethyloct-6-enyl butanoate
Molecular Weight	226.35
Molecular Formula	C14H26O2
Canonical SMILES	CCCC(=O)OCCC(C)CCC=C(C)C
InChI	InChI=1S/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3
InChI Key	XQPZQXTWYZAXAK-UHFFFAOYSA-N
Boiling Point	245 °C
Melting Point	-22.4 °C
Flash Point	>230 °F
Purity	98%+
Density	0.873 g/mL at 25 °C(lit.)
Solubility	Miscible with alcohol, ether, most fixed oils, chloroform; insoluble in water
Exact Mass	226.193280068
Monoisotopic Mass	226.193280068
Physical State	Liquid
Refractive Index	n20/D 1.445(lit.)
Topological Polar Surface Area	26.3 Ų