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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :110 ', '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 Colourless 油状Liquid 。像果酒及椰子样的香气。 ', '2 . Density（g/mL,25/4℃） 18733 ', '3 相对. Density（20℃，4℃）08799 ', '4 . Melting point（ºC）30 ', '5 . Boiling point（ºC,Atmospheric pressure）2135~214 ', '6 常温. Refractive index（n20）14214 ', '7 . Refractive index(n20D) 1421 ', '8 . Flash point（ºC） 84 ', '9 . Specific rotation（º） Unknow ', '10 气相标准. Combustion heat(焓)(kJ·mol-1)-623918 ', '11 气相标准声称热(焓)( kJ·mol-1) -55421 ', '12 液相标准. Combustion heat(焓)(kJ·mol-1)-617717 ', '13 液相标准声称热(焓)( kJ·mol-1)-61632 ', '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 Insoluble in Water ，Soluble in Ethanol and Ethyl ether 。']
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