IUPAC Name :[(2E)-1-[4-(2-benzamidoethyl)phenoxy]-3,7-dimethylocta-2,6-dien-4-yl] octadecanoate
InChI :InChI=1/C43H65NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-42(45)48-41(31-26-36(2)3)37(4)33-35-47-40-29-27-38(28-30-40)32-34-44-43(46)39-23-20-19-21-24-39/h19-21,23-24,26-30,33,41H,5-18,22,25,31-32,34-35H2,1-4H3,(H,44,46)/b37-33+
Std.InChI: InChI=1S/C43H65NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-42(45)48-41(31-26-36(2)3)37(4)33-35-47-40-29-27-38(28-30-40)32-34-44-43(46)39-23-20-19-21-24-39/h19-21,23-24,26-30,33,41H,5-18,22,25,31-32,34-35H2,1-4H3,(H,44,46)/b37-33+
InChIKey :AKRJIIVORCSJLA-LAWMERGMBA
Std.InChIKey: AKRJIIVORCSJLA-LAWMERGMSA-N
SMILES :CCCCCCCCCCCCCCCCCC(=O)OC(CC=C(C)C)/C(=C/COC1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2)/C
Molar Refractivity :202.43 ± 0.5 cm3 (est)
Parachor :1644.3 ± 8.0 cm3 (est)
Index of Refraction :1.511 ± 0.05
(est)
Surface Tension :35.2 ± 7.0 dyne/cm (est)
Density :0.97 ± 0.1 g/cm3 (est)
Polarizability :80.24 ± 0.5 10-24cm3 (est)