IUPAC Name :2-[[1,3-bis[[(Z)-octadec-9-enoyl]oxy]-2-[[(Z)-octadec-9-enoyl]oxymethyl]propan-2-yl]amino]ethanesulfonic acid
InChI :InChI=1/C60H111NO9S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-57(62)68-54-60(61-52-53-71(65,66)67,55-69-58(63)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)56-70-59(64)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h25-30,61H,4-24,31-56H2,1-3H3,(H,65,66,67)/b28-25-,29-26-,30-27-
Std.InChI: InChI=1S/C60H111NO9S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-57(62)68-54-60(61-52-53-71(65,66)67,55-69-58(63)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)56-70-59(64)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h25-30,61H,4-24,31-56H2,1-3H3,(H,65,66,67)/b28-25-,29-26-,30-27-
InChIKey :ZNRMROYWLUIANC-IUPFWZBJBR
Std.InChIKey: ZNRMROYWLUIANC-IUPFWZBJSA-N
SMILES :CCCCCCCC/C=C\CCCCCCCC(=O)OCC(NCCS(=O)(=O)O)(COC(=O)CCCCCCC/C=C\CCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC
Molar Refractivity :299.21 ± 0.4 cm3 (est)
Parachor :2578.0 ± 4.0 cm3 (est)
Index of Refraction :1.488 ± 0.02
(est)
Surface Tension :38.1 ± 3.0 dyne/cm (est)
Density :0.985 ± 0.06 g/cm3 (est)
Polarizability :118.61 ± 0.5 10-24cm3 (est)