Product Name
Benzyl isovalerate
Category
Heterocyclic Organic Compound
Synonyms
Butanoic acid, 3-methyl-, phenylmethyl ester
IUPAC Name
Benzyl 3-methylbutanoate
Molecular Formula
C12H16O2
Canonical SMILES
CC(C)CC(=O)OCC1=CC=CC=C1
InChI
InChI=1S/C12H16O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChI Key
HVJKZICIMIWFCP-UHFFFAOYSA-N
Density
0.988 g/mL at 25 °C(lit.)
Solubility
Insoluble in water; poorly soluble in glycerol, propylene glycol; soluble in oils
Monoisotopic Mass
192.115029749
Refractive Index
n20/D 1.488(lit.)
Topological Polar Surface Area
26.3 Ų
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