3-oxo-7,8-dihydro-alpha-ionone
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IUPAC Name :3,5,5-trimethyl-4-(3-oxobutyl)cyclohex-2-en-1-one
InChI :InChI=1/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h7,12H,5-6,8H2,1-4H3
Std.InChI: InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h7,12H,5-6,8H2,1-4H3
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InChIKey :GSTVTHMQXVKNQF-UHFFFAOYAL
Std.InChIKey: GSTVTHMQXVKNQF-UHFFFAOYSA-N
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SMILES :CC1=CC(=O)CC(C1CCC(=O)C)(C)C
Molar Refractivity :60.05 ± 0.3 cm3 (est)
Parachor :509.6 ± 6.0 cm3 (est)
Index of Refraction :1.457 ± 0.02 (est)
Surface Tension :28.6 ± 3.0 dyne/cm (est)
Density :0.945 ± 0.06 g/cm3 (est)
Polarizability :23.80 ± 0.5 10-24cm3 (est)