二叔丁基羟基亚苄基樟脑 di-t-butyl hydroxybenzylidene camphor

右键点击后面的免费Jmol Molecule链接获取更多信息 Right Click Free Jmol Molecule For More Options. 戳 Click 这里 Here.
iupac名称 IUPAC Name :(1R,2e 2E,4s)-2-[(3 4S)-2-[(3,5-二叔丁基-4-羟苯基)亚甲基] -4 5-ditert-butyl-4-hydroxyphenyl)methylidene]-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
INCHI InChI :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
印地 Std.InChI: 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
INCHI基 InChIKey :AYNVFOYKBKUQQR-KMJWFZQABI
标准奇奇 Std.InChIKey: AYNVFOYKBKUQQR-KMJWFZQASA-N
微笑 SMILES :C[C@]12CC[c @ h C@H](C1(C)C)/C(= c =C\C3= c =CC(= c =C(C(= c =C3)C(C)(C)C)O)C(C)(C)C)/C2=O
磨牙 Molar 折射率 Refractivity :113.69 ± 0.3 cm3 (估 est)
Parachor :889.7 ± 6.0 cm3 (估 est)
折射率 Index of Refraction :1.554 ± 0.02 (估 est)
表面张力 Surface Tension :39.6 ± 3.0 dyne/cm (估 est)
密度 Density :1.039 ± 0.06 g/cm3 (估 est)
极化率 Polarizability :45.07 ± 0.5 10-24cm3 (估 est)