IUPAC Name :(1R,2E,4S)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
InChI :InChI=1/C25H36O2/c1-22(2,3)18-13-15(14-19(20(18)26)23(4,5)6)12-16-17-10-11-25(9,21(16)27)24(17,7)8/h12-14,17,26H,10-11H2,1-9H3/b16-12+/t17-,25+/m0/s1
Std.InChI: InChI=1S/C25H36O2/c1-22(2,3)18-13-15(14-19(20(18)26)23(4,5)6)12-16-17-10-11-25(9,21(16)27)24(17,7)8/h12-14,17,26H,10-11H2,1-9H3/b16-12+/t17-,25+/m0/s1
InChIKey :AYNVFOYKBKUQQR-KMJWFZQABI
Std.InChIKey: AYNVFOYKBKUQQR-KMJWFZQASA-N
SMILES :C[C@]12CC[C@H](C1(C)C)/C(=C\C3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)/C2=O
Molar Refractivity :113.69 ± 0.3 cm3 (est)
Parachor :889.7 ± 6.0 cm3 (est)
Index of Refraction :1.554 ± 0.02
(est)
Surface Tension :39.6 ± 3.0 dyne/cm (est)
Density :1.039 ± 0.06 g/cm3 (est)
Polarizability :45.07 ± 0.5 10-24cm3 (est)