IUPAC Name :(1S,5R,8R)-1,5-dimethyl-8-[(E)-3-oxobut-1-enyl]-6-oxabicyclo[3.2.1]octan-3-one
InChI :InChI=1/C13H18O3/c1-9(14)4-5-11-12(2)6-10(15)7-13(11,3)16-8-12/h4-5,11H,6-8H2,1-3H3/b5-4+/t11-,12-,13-/m1/s1
Std.InChI: InChI=1S/C13H18O3/c1-9(14)4-5-11-12(2)6-10(15)7-13(11,3)16-8-12/h4-5,11H,6-8H2,1-3H3/b5-4+/t11-,12-,13-/m1/s1
InChIKey :LYMNQFZEIGCRGT-GDNMSKEOBA
Std.InChIKey: LYMNQFZEIGCRGT-GDNMSKEOSA-N
SMILES :CC(=O)/C=C/[C@@H]1[C@@]2(CC(=O)C[C@]1(OC2)C)C
Molar Refractivity :61.69 ± 0.3 cm3 (est)
Parachor :500.5 ± 6.0 cm3 (est)
Index of Refraction :1.564 ± 0.02
(est)
Surface Tension :48.6 ± 3.0 dyne/cm (est)
Density :1.172 ± 0.06 g/cm3 (est)
Polarizability :24.45 ± 0.5 10-24cm3 (est)