Specification
Synonyms
Propanoic acid, 2-hydroxy-, (3Z)-3-hexen-1-yl ester
IUPAC Name
[(Z)-Hex-3-enyl] 2-hydroxypropanoate
Canonical SMILES
CCC=CCCOC(=O)C(C)O
InChI
InChI=1S/C9H16O3/c1-3-4-5-6-7-12-9(11)8(2)10/h4-5,8,10H,3,6-7H2,1-2H3/b5-4-
InChI Key
NNLLMULULOBXBY-PLNGDYQASA-N
Density
0.982 g/mL at 25 °C(lit.)
Solubility
Slightly soluble in water; soluble in organic solvents, oils
Isomeric SMILES
CC/C=C\CCOC(=O)C(C)O
Monoisotopic Mass
172.109944368
Refractive Index
n20/D 1.446(lit.)
Topological Polar Surface Area
46.5 Ų