Geranyl phenylacetate

Catalog	ACM102227
CAS	102-22-7
Structure
Synonyms	Phenylacetic acid, geranyl ester
IUPAC Name	[(2E)-3,7-Dimethylocta-2,6-dienyl] 2-phenylacetate
Molecular Weight	272.4
Molecular Formula	C18H24O2
Canonical SMILES	CC(=CCCC(=CCOC(=O)CC1=CC=CC=C1)C)C
InChI	InChI=1S/C18H24O2/c1-15(2)8-7-9-16(3)12-13-20-18(19)14-17-10-5-4-6-11-17/h4-6,8,10-12H,7,9,13-14H2,1-3H3/b16-12+
InChI Key	UXAIJXIHZDZMSK-FOWTUZBSSA-N
Boiling Point	278 °C
Flash Point	>230 °F
Purity	98%+
Density	0.972 g/mL at 25 °C(lit.)
Solubility	Insoluble in water; soluble in oils
Exact Mass	272.177630004
Isomeric SMILES	CC(=CCC/C(=C/COC(=O)CC1=CC=CC=C1)/C)C
Monoisotopic Mass	272.177630004
Physical State	Liquid
Refractive Index	n20/D 1.509(lit.)
Topological Polar Surface Area	26.3 Ų