IUPAC Name :3-[2,3-dihydroxy-5-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]phenyl]-5-[(6E)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]benzene-1,2-diol
InChI :InChI=1/C42H58O4/c1-11-41(9,23-15-21-31(7)19-13-17-29(3)4)33-25-35(39(45)37(43)27-33)36-26-34(28-38(44)40(36)46)42(10,12-2)24-16-22-32(8)20-14-18-30(5)6/h11-12,17-18,21-22,25-28,43-46H,1-2,13-16,19-20,23-24H2,3-10H3/b31-21+,32-22+
Std.InChI: InChI=1S/C42H58O4/c1-11-41(9,23-15-21-31(7)19-13-17-29(3)4)33-25-35(39(45)37(43)27-33)36-26-34(28-38(44)40(36)46)42(10,12-2)24-16-22-32(8)20-14-18-30(5)6/h11-12,17-18,21-22,25-28,43-46H,1-2,13-16,19-20,23-24H2,3-10H3/b31-21+,32-22+
InChIKey :FBBLBOYXADGJGC-RWRHWQIFBY
Std.InChIKey: FBBLBOYXADGJGC-RWRHWQIFSA-N
SMILES :CC(=CCC/C(=C/CCC(C1=CC(=C(C(=C1)C2=CC(=CC(=C2O)O)C(C=C)(CC/C=C(/CCC=C(C)C)\C)C)O)O)(C=C)C)/C)C
Molar Refractivity :196.12 ± 0.3 cm3 (est)
Parachor :1523.6 ± 4.0 cm3 (est)
Index of Refraction :1.557 ± 0.02
(est)
Surface Tension :39.2 ± 3.0 dyne/cm (est)
Density :1.029 ± 0.06 g/cm3 (est)
Polarizability :77.74 ± 0.5 10-24cm3 (est)