IUPAC Name :2,3-bis[[(E)-12-hydroxyoctadec-9-enoyl]oxy]propyl (E)-12-hydroxyoctadec-9-enoate
InChI :InChI=1/C57H104O9/c1-4-7-10-31-40-51(58)43-34-25-19-13-16-22-28-37-46-55(61)64-49-54(66-57(63)48-39-30-24-18-15-21-27-36-45-53(60)42-33-12-9-6-3)50-65-56(62)47-38-29-23-17-14-20-26-35-44-52(59)41-32-11-8-5-2/h25-27,34-36,51-54,58-60H,4-24,28-33,37-50H2,1-3H3/b34-25+,35-26+,36-27+
Std.InChI: InChI=1S/C57H104O9/c1-4-7-10-31-40-51(58)43-34-25-19-13-16-22-28-37-46-55(61)64-49-54(66-57(63)48-39-30-24-18-15-21-27-36-45-53(60)42-33-12-9-6-3)50-65-56(62)47-38-29-23-17-14-20-26-35-44-52(59)41-32-11-8-5-2/h25-27,34-36,51-54,58-60H,4-24,28-33,37-50H2,1-3H3/b34-25+,35-26+,36-27+
InChIKey :ZEMPKEQAKRGZGQ-GXCCKLQBBJ
Std.InChIKey: ZEMPKEQAKRGZGQ-GXCCKLQBSA-N
SMILES :CCCCCCC(O)C/C=C/CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C/CC(O)CCCCCC)COC(=O)CCCCCCC/C=C/CC(O)CCCCCC
Molar Refractivity :276.05 ± 0.3 cm3 (est)
Parachor :2375.4 ± 4.0 cm3 (est)
Index of Refraction :1.490 ± 0.02
(est)
Surface Tension :38.3 ± 3.0 dyne/cm (est)
Density :0.977 ± 0.06 g/cm3 (est)
Polarizability :109.43 ± 0.5 10-24cm3 (est)