(Z)-3-Hexenyl butanoate

CAS	16491-36-4
Structure
Synonyms	Butanoic acid, (3Z)-3-hexen-1-yl ester
IUPAC Name	[(Z)-Hex-3-enyl] butanoate
Molecular Weight	170.25
Canonical SMILES	CCCC(=O)OCCC=CCC
InChI	InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5-
InChI Key	ZCHOPXVYTWUHDS-WAYWQWQTSA-N
Boiling Point	96 °C
Flash Point	174 °F
Purity	99%
Density	0.885 g/mL at 25 °C(lit.)
Solubility	Soluble in alcohol, propylene glycol; miscible with most fixed oils; insoluble in water
Exact Mass	170.130679813
Isomeric SMILES	CCCC(=O)OCC/C=C\CC
Monoisotopic Mass	170.130679813
Physical State	Liquid
Refractive Index	n20/D 1.431(lit.)
Storage Conditions	Inert atmosphere,Room Temperature
Topological Polar Surface Area	26.3 Ų