5-巯基-5-甲基-3-己酮 5-mercapto-5-methyl-3-hexanone
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iupac名称 IUPAC Name :5-甲基-5-硫烷基己基-3-一 5-methyl-5-sulfanylhexan-3-one
INCHI InChI :INCHI InChI=1/C7H14OS/c1-4-6(8)5-7(2,3)9/h9H,4-5H2,1-3h3 1-3H3
印地 Std.InChI: INCHI InChI=1S/C7H14OS/c1-4-6(8)5-7(2,3)9/h9H,4-5H2,1-3h3 1-3H3
INCHI基 InChIKey :KTTLFUWDFUJAKG-UHFFFAOYAM
标准奇奇 Std.InChIKey: KTTLFUWDFUJAKG-UHFFFAOYSA-N
微笑 SMILES :o = c O=C(cc CC)cc CC(S)(C)C
WLN: SHX1&1&1V2
磨牙 Molar 折射率 Refractivity :42.37 ± 0.3 cm3 (估 est)
Parachor :362.6 ± 4.0 cm3 (估 est)
折射率 Index of Refraction :1.457 ± 0.02 (估 est)
表面张力 Surface Tension :29.7 ± 3.0 dyne/cm (估 est)
密度 Density :0.941 ± 0.06 g/cm3 (估 est)
极化率 Polarizability :16.79 ± 0.5 10-24cm3 (估 est)