diethylhexyl IPDI

Right Click Jmol Molecule For More Options. Jmol is a free download found Here.
IUPAC Name :2-ethylhexyl N-[3-[(2-ethylhexoxycarbonylamino)methyl]-3,5,5-trimethylcyclohexyl]carbamate
InChI :InChI=1/C28H54N2O4/c1-8-12-14-22(10-3)18-33-25(31)29-21-28(7)17-24(16-27(5,6)20-28)30-26(32)34-19-23(11-4)15-13-9-2/h22-24H,8-21H2,1-7H3,(H,29,31)(H,30,32)
Std.InChI: InChI=1S/C28H54N2O4/c1-8-12-14-22(10-3)18-33-25(31)29-21-28(7)17-24(16-27(5,6)20-28)30-26(32)34-19-23(11-4)15-13-9-2/h22-24H,8-21H2,1-7H3,(H,29,31)(H,30,32)
InChIKey :XQEIGFORGRLJGC-UHFFFAOYAP
Std.InChIKey: XQEIGFORGRLJGC-UHFFFAOYSA-N
SMILES :CCCCC(CC)COC(=O)NCC1(CC(CC(C1)(C)C)NC(=O)OCC(CC)CCCC)C
Molar Refractivity :139.40 ± 0.5 cm3 (est)
Parachor :1146.9 ± 8.0 cm3 (est)
Index of Refraction :1.497 ± 0.05 (est)
Surface Tension :33.7 ± 7.0 dyne/cm (est)
Density :1.01 ± 0.1 g/cm3 (est)
Polarizability :55.26 ± 0.5 10-24cm3 (est)