IUPAC Name :3-[(1S,2S,3S)-2,3-dimethyl-2-[(2-oxochromen-7-yl)oxymethyl]-6-propan-2-ylidenecyclohexyl]propanoic acid
InChI :InChI=1/C24H30O5/c1-15(2)19-9-5-16(3)24(4,20(19)10-11-22(25)26)14-28-18-8-6-17-7-12-23(27)29-21(17)13-18/h6-8,12-13,16,20H,5,9-11,14H2,1-4H3,(H,25,26)/t16-,20-,24-/m0/s1
Std.InChI: InChI=1S/C24H30O5/c1-15(2)19-9-5-16(3)24(4,20(19)10-11-22(25)26)14-28-18-8-6-17-7-12-23(27)29-21(17)13-18/h6-8,12-13,16,20H,5,9-11,14H2,1-4H3,(H,25,26)/t16-,20-,24-/m0/s1
InChIKey :CVWWNYPTZYQCSE-YFBXQHAEBT
Std.InChIKey: CVWWNYPTZYQCSE-YFBXQHAESA-N
SMILES :C[C@H]1CCC(=C(C)C)[C@@H]([C@@]1(C)COC2=CC3=C(C=C2)C=CC(=O)O3)CCC(=O)O
Molar Refractivity :110.45 ± 0.3 cm3 (est)
Parachor :890.3 ± 6.0 cm3 (est)
Index of Refraction :1.538 ± 0.02
(est)
Surface Tension :40.6 ± 3.0 dyne/cm (est)
Density :1.130 ± 0.06 g/cm3 (est)
Polarizability :43.78 ± 0.5 10-24cm3 (est)