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Computational_Chemistry:
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['1. XlogP :01 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :11 ', '5. Isotope Atom Count :N/A ', '6. TPSA 991 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :304 ', '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 透明Liquid ，具有甜and 愉快的果子酒梅子样香气 ', '2 . Density（g/mL,20/4℃）11369 ', '3 常温. Refractive index（n20）14455 ', '4 . Melting point（ºC）-55 ', '5 . Boiling point（ºC,Atmospheric pressure）294 ', '6 . Boiling point（ºC,0133kPa）127 ', '7 . Refractive index（20ºC）14455 ', '8 . Flash point（ºC）110 ', '9 . Specific rotation（º）不确定 ', '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 Soluble in 大多数有机溶剂。难Soluble in 油类。与大多数纤维素聚氯乙烯聚醋酸乙烯树脂及氯化橡胶等有良好的相容性。25℃Water 中溶解度65g/100mL。']
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