InChI :InChI=1/C49H34O29/c50-15-2-1-10(3-17(15)52)37-21(56)4-11-16(51)8-23-27(38(11)73-37)29-40-41(39-22(57)9-72-42(64)12-5-18(53)31(58)34(61)24(12)25-13(43(65)74-39)6-19(54)32(59)35(25)62)76-44(66)14-7-20(55)33(60)36(63)26(14)28-30(45(67)75-40)48(29,77-23)47(70)78-49(28,71)46(68)69/h1-3,5-8,21-22,29,37,39-41,50-63,71H,4,9H2,(H,68,69)
Std.InChI: InChI=1S/C49H34O29/c50-15-2-1-10(3-17(15)52)37-21(56)4-11-16(51)8-23-27(38(11)73-37)29-40-41(39-22(57)9-72-42(64)12-5-18(53)31(58)34(61)24(12)25-13(43(65)74-39)6-19(54)32(59)35(25)62)76-44(66)14-7-20(55)33(60)36(63)26(14)28-30(45(67)75-40)48(29,77-23)47(70)78-49(28,71)46(68)69/h1-3,5-8,21-22,29,37,39-41,50-63,71H,4,9H2,(H,68,69)
InChIKey :MMIYRWRTSJNIBU-UHFFFAOYAV
Std.InChIKey: MMIYRWRTSJNIBU-UHFFFAOYSA-N
SMILES :C1C(C(OC2=C3C4C5C(OC(=O)C6=CC(=C(C(=C6C7=C(C4(C(=O)OC7(C(=O)O)O)OC3=CC(=C21)O)C(=O)O5)O)O)O)C8C(COC(=O)C9=CC(=C(C(=C9C1=C(C(=C(C=C1C(=O)O8)O)O)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O
Molar Refractivity :237.98 ± 0.4 cm3 (est)
Parachor :1855.2 ± 6.0 cm3 (est)
Index of Refraction :1.971 ± 0.03
(est)
Surface Tension :213.5 ± 5.0 dyne/cm (est)
Density :2.23 ± 0.1 g/cm3 (est)
Polarizability :94.34 ± 0.5 10-24cm3 (est)