IUPAC Name :5-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]sulfanyl-1H-1,2,4-triazole
InChI :InChI=1/C17H27N3S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-21-17-18-13-19-20-17/h7,9,11,13H,5-6,8,10,12H2,1-4H3,(H,18,19,20)/b15-9+,16-11+
Std.InChI: InChI=1S/C17H27N3S/c1-14(2)7-5-8-15(3)9-6-10-16(4)11-12-21-17-18-13-19-20-17/h7,9,11,13H,5-6,8,10,12H2,1-4H3,(H,18,19,20)/b15-9+,16-11+
InChIKey :QFXNCKFWHATRCH-XGGJEREUBH
Std.InChIKey: QFXNCKFWHATRCH-XGGJEREUSA-N
SMILES :CC(=CCC/C(=C/CC/C(=C/CSC1=NC=NN1)/C)/C)C
Molar Refractivity :92.78 ± 0.4 cm3 (est)
Parachor :761.1 ± 6.0 cm3 (est)
Index of Refraction :1.542 ± 0.03
(est)
Surface Tension :44.5 ± 5.0 dyne/cm (est)
Density :1.03 ± 0.1 g/cm3 (est)
Polarizability :36.78 ± 0.5 10-24cm3 (est)