IUPAC Name :4-(ethoxymethyl)-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid
InChI :InChI=1/C20H18O9/c1-4-27-7-11-15(23)14(19(24)25)9(3)16-18(11)29-20(26)13-8(2)5-12(22)10(6-21)17(13)28-16/h5-6,22-23H,4,7H2,1-3H3,(H,24,25)
Std.InChI: InChI=1S/C20H18O9/c1-4-27-7-11-15(23)14(19(24)25)9(3)16-18(11)29-20(26)13-8(2)5-12(22)10(6-21)17(13)28-16/h5-6,22-23H,4,7H2,1-3H3,(H,24,25)
InChIKey :SPLUKWYWJOQKMJ-UHFFFAOYAR
Std.InChIKey: SPLUKWYWJOQKMJ-UHFFFAOYSA-N
SMILES :O=C(O)c2c(O)c(c1OC(=O)c3c(Oc1c2C)c(c(O)cc3C)C=O)COCC
Molar Refractivity :100.16 ± 0.3 cm3 (est)
Parachor :783.6 ± 6.0 cm3 (est)
Index of Refraction :1.658 ± 0.02
(est)
Surface Tension :69.2 ± 3.0 dyne/cm (est)
Density :1.480 ± 0.06 g/cm3 (est)
Polarizability :39.70 ± 0.5 10-24cm3 (est)