Neryl isobutyrate

CAS	2345-24-6
Structure
Synonyms	Isobutyric acid 3,7-dimethyl-2,6-octadienyl ester
IUPAC Name	[(2Z)-3,7-Dimethylocta-2,6-dienyl] 2-methylpropanoate
Molecular Weight	224.34
Canonical SMILES	CC(C)C(=O)OCC=C(C)CCC=C(C)C
InChI	InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9-
InChI Key	OGJYXQFXLSCKTP-LCYFTJDESA-N
Boiling Point	229 °C
Flash Point	>230 °F
Purity	95%+
Density	0.895 g/mL at 25 °C(lit.)
Solubility	Practically insoluble in water
Exact Mass	224.177630004
Isomeric SMILES	CC(C)C(=O)OC/C=C(/C)\CCC=C(C)C
Monoisotopic Mass	224.177630004
Physical State	Liquid
Refractive Index	n20/D 1.457(lit.)
Topological Polar Surface Area	26.3 Ų