Benzenebutanoic acid, ethyl ester

CAS	10031-93-3
Structure
Synonyms	4-Phenylbutyric acid ethyl
IUPAC Name	Ethyl 4-phenylbutanoate
Molecular Weight	192.25
Canonical SMILES	CCOC(=O)CCCC1=CC=CC=C1
InChI	InChI=1S/C12H16O2/c1-2-14-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
InChI Key	GGFNXKFGVQQNRV-UHFFFAOYSA-N
Boiling Point	100 °C
Purity	95%+
Density	1.001 g/cm³
Solubility	Soluble in oils; insoluble in water
Exact Mass	192.115029749
Monoisotopic Mass	192.115029749
Odor	Fruity, floral aroma
Physical State	Oily liquid
Refractive Index	n20/D 1.491-1.495(lit.)
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	26.3 Ų