IUPAC Name :2-ethylhexyl 4-[[4,6-bis[4-(2-ethylhexoxycarbonyl)anilino]-1,3,5-triazin-2-yl]amino]benzoate
InChI :InChI=1/C48H66N6O6/c1-7-13-16-34(10-4)31-58-43(55)37-19-25-40(26-20-37)49-46-52-47(50-41-27-21-38(22-28-41)44(56)59-32-35(11-5)17-14-8-2)54-48(53-46)51-42-29-23-39(24-30-42)45(57)60-33-36(12-6)18-15-9-3/h19-30,34-36H,7-18,31-33H2,1-6H3,(H3,49,50,51,52,53,54)
Std.InChI: InChI=1S/C48H66N6O6/c1-7-13-16-34(10-4)31-58-43(55)37-19-25-40(26-20-37)49-46-52-47(50-41-27-21-38(22-28-41)44(56)59-32-35(11-5)17-14-8-2)54-48(53-46)51-42-29-23-39(24-30-42)45(57)60-33-36(12-6)18-15-9-3/h19-30,34-36H,7-18,31-33H2,1-6H3,(H3,49,50,51,52,53,54)
InChIKey :JGUMTYWKIBJSTN-UHFFFAOYAV
Std.InChIKey: JGUMTYWKIBJSTN-UHFFFAOYSA-N
SMILES :CCCCC(CC)COC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)C(=O)OCC(CC)CCCC)NC4=CC=C(C=C4)C(=O)OCC(CC)CCCC
Molar Refractivity :241.13 ± 0.3 cm3 (est)
Parachor :1911.9 ± 4.0 cm3 (est)
Index of Refraction :1.576 ± 0.02
(est)
Surface Tension :47.3 ± 3.0 dyne/cm (est)
Density :1.129 ± 0.06 g/cm3 (est)
Polarizability :95.59 ± 0.5 10-24cm3 (est)