IUPAC Name :butyl (E)-18-sulfooxyoctadec-9-enoate
InChI :InChI=1/C22H42O6S/c1-2-3-20-27-22(23)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-21-28-29(24,25)26/h4-5H,2-3,6-21H2,1H3,(H,24,25,26)/b5-4+
Std.InChI: InChI=1S/C22H42O6S/c1-2-3-20-27-22(23)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-21-28-29(24,25)26/h4-5H,2-3,6-21H2,1H3,(H,24,25,26)/b5-4+
InChIKey :DCFGGGCMICWSJX-SNAWJCMRBL
Std.InChIKey: DCFGGGCMICWSJX-SNAWJCMRSA-N
SMILES :CCCCOC(=O)CCCCCCC/C=C/CCCCCCCCOS(=O)(=O)O
Molar Refractivity :113.6 ± 0.3 cm3 (est)
Parachor :1038.9 ± 4.0 cm3 (est)
Index of Refraction :1.481 ± 0.02 (est)
Surface Tension :39.7 ± 3.0 dyne/cm (est)
Density :1.050 ± 0.06 g/cm3 (est)
Polarizability :46.69 ± 0.5 10-24cm3 (est)