Product Name
Isobutyl benzoate
Category
Heterocyclic Organic Compound
Synonyms
Benzoic acid isobutyl
IUPAC Name
2-Methylpropyl benzoate
Molecular Formula
C11H14O2
Canonical SMILES
CC(C)COC(=O)C1=CC=CC=C1
InChI
InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChI Key
KYZHGEFMXZOSJN-UHFFFAOYSA-N
Density
0.996 g/mL at 25 °C(lit.)
Solubility
Insoluble in water; soluble in organic solvents, oils
Appearance
Clear colorless liquid
Monoisotopic Mass
178.099379685
Odor
Green, floral, leafy odor
Refractive Index
n20/D 1.495(lit.)
Topological Polar Surface Area
26.3 Ų