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Computational_Chemistry:
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['1. XlogP :48 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :22 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :542 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :4 ', '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 微黄to 黄红色玻璃状Solid 。 ', '2 . Density（g/mL,25/4℃） 1067 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）172～175℃ ', '5 . Boiling point（ºC,Atmospheric pressure）300 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index15453 ', '8 . Flash point（ºC）216 ', '9 . Specific rotation（º，C=1, 无Water Ethanol ）-106 ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）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 Insoluble in Water ，微Soluble in 热Water ，易Soluble in Ethanol Ethyl ether 丙酮苯二氯乙烷二硫化碳松节油石油醚汽油等有机溶剂，并Soluble in 油类and 碱溶液。 20 软化点（环球法）72～74℃ ', '21 着火点480～500℃']
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