7-Isopropyl-4-methyloxepan-2-one

CAS	499-54-7
Structure
Synonyms	3,7-Dimethyl-6-octanolide
IUPAC Name	4-Methyl-7-propan-2-yloxepan-2-one
Molecular Weight	170.25
Canonical SMILES	CC1CCC(OC(=O)C1)C(C)C
InChI	InChI=1S/C10H18O2/c1-7(2)9-5-4-8(3)6-10(11)12-9/h7-9H,4-6H2,1-3H3
InChI Key	GGAXPLCKKANQED-UHFFFAOYSA-N
Boiling Point	248.3±8.0 °C
Purity	98%+
Density	0.926±0.06 g/cm³
Solubility	Very soluble in water and soluble in alcohol
Exact Mass	170.130679813
Monoisotopic Mass	170.130679813
Odor	Maple syrup or brown sugar odor
Physical State	Solid
Refractive Index	n20/D 1.457-1.461(lit.)
Topological Polar Surface Area	26.3 Ų