IUPAC Name :(2S,3R,3aS)-2-(3,4-dimethoxyphenyl)-3a-methoxy-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one
InChI :InChI=1/C21H24O5/c1-6-7-15-12-21(25-5)13(2)20(26-19(21)11-16(15)22)14-8-9-17(23-3)18(10-14)24-4/h6,8-13,20H,1,7H2,2-5H3/t13-,20+,21+/m1/s1
Std.InChI: InChI=1S/C21H24O5/c1-6-7-15-12-21(25-5)13(2)20(26-19(21)11-16(15)22)14-8-9-17(23-3)18(10-14)24-4/h6,8-13,20H,1,7H2,2-5H3/t13-,20+,21+/m1/s1
InChIKey :VDYACOATPFOZIO-UBWHGVKJBA
Std.InChIKey: VDYACOATPFOZIO-UBWHGVKJSA-N
SMILES :C[C@@H]1[C@H](OC2=CC(=O)C(=C[C@]12OC)CC=C)C3=CC(=C(C=C3)OC)OC
MDL: MFCD00869351
Molar Refractivity :98.28 ± 0.4 cm3 (est)
Parachor :777.7 ± 6.0 cm3 (est)
Index of Refraction :1.565 ± 0.03
(est)
Surface Tension :44.1 ± 5.0 dyne/cm (est)
Density :1.18 ± 0.1 g/cm3 (est)
Polarizability :38.96 ± 0.5 10-24cm3 (est)