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Computational_Chemistry:
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['1 . XlogP 33 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count ', '6 . TPSA 373 ', '7 . Heavy Atom Count 13 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 200 ', '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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More_Info:
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['1 . Appearance White 片状or 针状结晶 ', '2 相对. Density（25℃，4℃）1077100 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）185 ', '5 . Boiling point（ºC,Atmospheric pressure）>300 ', '6 气相标准. Combustion heat(焓)(kJ·mol-1)-52395 ', '7 气相标准声称热(焓)( kJ·mol-1) -2325 ', '8 . Flash point（ºC） 205 ', '9 晶相相标准. Combustion heat(焓)(kJ·mol-1)-51259 ', '12 晶相标准声称热(焓)( kJ·mol-1)-3461 ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Soluble in 醚and 醇，微Soluble in 热Water 。']
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