Isobutyl heptanoate

CAS	7779-80-8
Structure
Synonyms	Heptanoic acid, isobutyl ester
IUPAC Name	2-Methylpropyl heptanoate
Molecular Weight	186.29
Canonical SMILES	CCCCCCC(=O)OCC(C)C
InChI	InChI=1S/C11H22O2/c1-4-5-6-7-8-11(12)13-9-10(2)3/h10H,4-9H2,1-3H3
InChI Key	HXJOYVPESRRCDB-UHFFFAOYSA-N
Boiling Point	220.8 °C
Melting Point	-67.5 °C
Purity	95%+
Density	0.8593 g/mL at 25 °C(lit.)
Solubility	Soluble in most organic solvents
Exact Mass	186.16197994
Monoisotopic Mass	186.16197994
Odor	Green odor
Physical State	Liquid
Refractive Index	n20/D 1.3927(lit.)
Topological Polar Surface Area	26.3 Ų