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Refractive_Index:
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n20/D 1.488(lit.)
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Vapor_Pressure:
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0.0294mmHg at 25°C
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Flash_Point:
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>230 °F
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LogP:
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2.77590
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Bolling_Point:
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116 °C9 mm Hg(lit.)
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FW:
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192.25400
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PSA:
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26.30000
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Computational_Chemistry:
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['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 5 ', '5 . Isotope Atom Count ', '6 . TPSA 263 ', '7 . Heavy Atom Count 14 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 169 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
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MF:
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C12H16O2
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Exact_Mass:
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192.11500
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Molecular_Structure:
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['1 . Molar refractive index 5606 ', '2 . Molar volume 1921 ', '3 . Parachor (902K)4651 ', '4 . Surface tension 343 ', '5 . Dielectric constant ', '6 偶极距(10-24cm3) ', '7 . Polarizability 2222']
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Density:
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0.988 g/mL at 25 °C(lit.)
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More_Info:
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['1 . Appearance Liquid ,有强烈的果香and 花香香气,并有荔枝梨杏仁核茉莉玫瑰香韵。 ', '2 . Boiling point(ºC,Atmospheric pressure)245, 136(33kpa) ', '3 相对. Density(d154) 09983 ', '4 . Refractive index(n20D)14884']
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