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Computational_Chemistry:
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['1. XlogP :08 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 405 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :918 ', '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 在乙酸乙酯中析出棱晶，在石油醚中析出薄片状结晶。White 结晶。 ', '2 相对. Density（g/mL,20/20℃）0898 ', '3相对. Density（20℃，4℃）0898 ', '4 . Melting point（ºC）92 ', '5 . Boiling point（ºC,Atmospheric pressure）214 ', '6 晶相相标准. Combustion heat(焓)(kJ·mol-1)-50388 ', '7 晶相标准声称热(焓)( kJ·mol-1)-6817 ', '8 . Flash point（ºC）126 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg, ºC）Unknow ', '12 . Saturated vapor pressure（kPa,ºC）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 Water 丙酮 Ethanol 苯氯仿，Insoluble in 四氯化碳and 煤油。']
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