牡丹乙腈 peony acetonitrile
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iupac名称 IUPAC Name :2-环己基-2-苯基乙腈 2-cyclohexylidene-2-phenylacetonitrile
INCHI InChI :INCHI InChI=1/C14H15N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-10H2
印地 Std.InChI: INCHI InChI=1S/C14H15N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-10H2
INCHI基 InChIKey :ZHOOOLQOWQVYOE-UHFFFAOYAJ
标准奇奇 Std.InChIKey: ZHOOOLQOWQVYOE-UHFFFAOYSA-N
微笑 SMILES :C1CCC(= c =C(C#N)C2= c =CC= c =CC= c =C2)CC1
WLN: L6YTJ AUYR&CN
磨牙 Molar 折射率 Refractivity :61.50 ± 0.3 cm3 (估 est)
Parachor :484.1 ± 6.0 cm3 (估 est)
折射率 Index of Refraction :1.569 ± 0.02 (估 est)
表面张力 Surface Tension :44.4 ± 3.0 dyne/cm (估 est)
密度 Density :1.052 ± 0.06 g/cm3 (估 est)
极化率 Polarizability :24.38 ± 0.5 10-24cm3 (估 est)