乐leerall /邻氨基苯甲酸甲酯席夫氏碱
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iupac名称 IUPAC Name :methyl 2-[[4-(4-hydroxy-4-methylpentyl)-1-cyclohex-3-enyl]methylideneamino]benzoate
INCHI InChI :INCHI InChI=1/C21H29NO3/c1-21(2,24)14-6-7-16-10-12-17(13-11-16)15-22-19-9-5-4-8-18(19)20(23)25-3/h4-5,8-10,15,17,24H,6-7,11-14H2,1-3h3 1-3H3
印地 Std.InChI: INCHI InChI=1S/C21H29NO3/c1-21(2,24)14-6-7-16-10-12-17(13-11-16)15-22-19-9-5-4-8-18(19)20(23)25-3/h4-5,8-10,15,17,24H,6-7,11-14H2,1-3h3 1-3H3
INCHI基 InChIKey :HNLBOCGUTPSUHX-PXLXIMEGBS
标准奇奇 Std.InChIKey: HNLBOCGUTPSUHX-PXLXIMEGSA-N
微笑 SMILES :cc CC(C)(cc CCcc CC1=cc CCC(cc CC1)C=NC2=cc CC=cc CC=C2C(= o =O)OC)O
磨牙 Molar 折射率 Refractivity :100.35 ± 0.5 cm3 (估 est)
Parachor :798.1 ± 8.0 cm3 (估 est)
折射率 Index of Refraction :1.535 ± 0.05 (估 est)
表面张力 Surface Tension :37.7 ± 7.0 dyne/cm (估 est)
密度 Density :1.06 ± 0.1 g/cm3 (估 est)
极化率 Polarizability :39.78 ± 0.5 10-24cm3 (估 est)