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Computational_Chemistry:
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['1. XlogP :05 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 434 ', '7. Heavy Atom Count :9 ', '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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More_Info:
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['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）1135g/mLat 25°C(lit) ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）32°C(lit) ', '5 . Boiling point（ºC,Atmospheric pressure）219-220°C(lit) ', '6 气相标准. Combustion heat(焓)(kJ·mol-1)-292269 ', '7 气相标准声称热(焓)( kJ·mol-1) -58170 ', '8 . Flash point（ºF）227 ', '9 液相标准. Combustion heat(焓)(kJ·mol-1)-285889 ', '10 液相标准声称热(焓)( kJ·mol-1)-64551 ', '11 晶相相标准. Combustion heat(焓)(kJ·mol-1)-285299 ', '12 晶相标准声称热(焓)( kJ·mol-1)-65141 ', '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 不确定']
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