Geranic acid

Catalog	ACM459803
CAS	459-80-3
Structure
Synonyms	6-Octadienoicacid,3,7-dimethyl-2
IUPAC Name	(2E)-3,7-Dimethylocta-2,6-dienoic acid
Molecular Weight	168.23
Molecular Formula	C10H16O2
Canonical SMILES	CC(=CCCC(=CC(=O)O)C)C
InChI	InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7+
InChI Key	ZHYZQXUYZJNEHD-VQHVLOKHSA-N
Boiling Point	250 °C
Melting Point	185-186 °C
Flash Point	>230 °F
Purity	95%+
Density	0.97 g/mL at 25 °C(lit.)
Solubility	Practically insoluble to insoluble in water
Exact Mass	168.115029749
Isomeric SMILES	CC(=CCC/C(=C/C(=O)O)/C)C
Monoisotopic Mass	168.115029749
Odor	Faint floral aroma
Physical State	Viscous liquid
Refractive Index	n20/D 1.484(lit.)
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	37.3 Ų