Tetrahydro-6-(3-pentenyl)-2H-pyran-2-one

CAS	32764-98-0
Structure
Synonyms	6-(3-Pentenyl)-tetrahydro-2H-pyran-2-one
IUPAC Name	6-[(E)-Pent-3-enyl]oxan-2-one
Molecular Weight	168.23
Canonical SMILES	CC=CCCC1CCCC(=O)O1
InChI	InChI=1S/C10H16O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h2-3,9H,4-8H2,1H3/b3-2+
InChI Key	NBCMACYORPIYNY-NSCUHMNNSA-N
Boiling Point	149-151 °C
Flash Point	>110 °C
Purity	98%+
Density	0.962±0.06 g/cm³
Solubility	Practically insoluble or insoluble in water
Exact Mass	168.115029749
Isomeric SMILES	C/C=C/CCC1CCCC(=O)O1
Monoisotopic Mass	168.115029749
Odor	Fruity, floral petal, jasmin, peach, apricot aroma
Physical State	Liquid
Refractive Index	n20/D 1.47-1.48(lit.)
Topological Polar Surface Area	26.3 Ų