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Computational_Chemistry:
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['1 . XlogP -4 ', '2 . Hydrogen Bond Donor Count 4 ', '3 . Hydrogen Bond Acceptor Count 5 ', '4 . Rotatable Bond Count 6 ', '5 . TPSA 121 ', '6 . Heavy Atom Count 16 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 259 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 1 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
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More_Info:
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['1. Appearance White to 浅棕黄无定形粉末颗粒or 块状，or 为透明to 褐色Liquid 2 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '3 . Melting point（ºC） Unknow ', '4 . Boiling point（ºC,Atmospheric pressure）Unknow ', '5 . Boiling point（ºC,52kPa）Unknow ', '6 . Refractive indexUnknow ', '7 . Flash point（ºC）Unknow ', '8 . Specific rotation（º）Unknow ', '9 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '10 . Vapor pressure（kPa,25ºC）Unknow ', '11 . Saturated vapor pressure（kPa,60ºC）Unknow ', '12 . Combustion heat（KJ/mol）Unknow ', '13 . Critical temperature（ºC）Unknow ', '14 . Critical pressure（KPa）Unknow ', '15 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '16 . Upper limit of explosion（%,V/V）Unknow ', '17 . Lower limit of explosion（%,V/V）Unknow ', '18 . Solubility 可Soluble in Water ，Water 溶液Colourless to 淡Yellow ，有时有乳白光。Insoluble in Ethanol 氯仿and Ethyl ether 。']
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