IUPAC Name :(E)-1-[(1R,6R)-2,2,6-trimethylcyclohexyl]but-2-en-1-one
InChI :InChI=1/C13H22O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7,10,12H,6,8-9H2,1-4H3/b7-5+/t10-,12+/m1/s1
Std.InChI: InChI=1S/C13H22O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7,10,12H,6,8-9H2,1-4H3/b7-5+/t10-,12+/m1/s1
InChIKey :DDDIVAXBYDCLRR-FLPUTOKSBG
Std.InChIKey: DDDIVAXBYDCLRR-FLPUTOKSSA-N
SMILES :C/C=C/C(=O)[C@@H]1[C@@H](CCCC1(C)C)C
Molar Refractivity :60.22 ± 0.3 cm3 (est)
Parachor :506.1 ± 6.0 cm3 (est)
Index of Refraction :1.453 ± 0.02 (est)
Surface Tension :26.6 ± 3.0 dyne/cm (est)
Density :0.872 ± 0.06 g/cm3 (est)
Polarizability :23.87 ± 0.5 10-24cm3 (est)