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Computational_Chemistry:
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['1 . Hydrogen Bond Donor Count 1 ', '2 . Hydrogen Bond Acceptor Count 4 ', '3 . Rotatable Bond Count 5 ', '4 . TPSA 664 ', '5 . Heavy Atom Count 15 ', '6 . Topological Polar Surface Area 0 ', '7 . Complexity 214 ', '8 . Isotope Atom Count 0 ', '9 . Defined Atom Stereocenter Count 1 ', '10 . Undefined Atom Stereocenter Count 0 ', '11 . Defined Bond Stereocenter Count 0 ', '12 . Undefined Bond Stereocenter Count 0 ', '13 . Covalently-Bonded Unit Count 2']
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More_Info:
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['1 . Appearance White 粉末 ', '2 . Density（g/mL,25）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）187-189 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC,03 mmHg）不确定 ', '7 . Refractive index（nD20）不确定 ', '8 . Flash point（°F）不确定 ', '9 . Specific rotation（º, C=1, Water ）-29 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 易Soluble in Water ，微Soluble in Ethanol ，几乎Insoluble in Ethyl ether 。']
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