2-Undecenal

CAS	53448-07-0 / 2463-77-6
Structure
Synonyms	3-Octylacrolein
IUPAC Name	(E)-Undec-2-enal
Molecular Weight	168.28
Canonical SMILES	CCCCCCCCC=CC=O
InChI	InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h9-11H,2-8H2,1H3/b10-9+
InChI Key	PANBRUWVURLWGY-MDZDMXLPSA-N
Boiling Point	115 °C
Melting Point	-12 °C
Flash Point	>230 °F
Purity	98%+
Density	0.849 g/mL at 25 °C(lit.)
Solubility	Soluble in oils; insoluble in water
Exact Mass	168.151415257
Isomeric SMILES	CCCCCCCC/C=C/C=O
Monoisotopic Mass	168.151415257
Odor	Fresh, fruity, orange peel aroma
Physical State	Liquid
Refractive Index	n20/D 1.457(lit.)
Topological Polar Surface Area	17.1 Ų