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More_Info:
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['一物性数据 ', '1 . Appearance White 鳞片状结晶 ', '2 . Density暂无 3 . Relative vapor density（g/mL,Atmosphere =1）0777 4 . Melting point（ºC）865 ～875 ', '5 . Boiling point（ºC,Atmospheric pressure）暂无 ', '6 . Boiling point（ºC,52kPa） 暂无 ', '7 . Refractive index暂无 ', '8 . Flash point（ºC）暂无 ', '9 . Specific rotation（º） 暂无 ', '10 . Spontaneous ignition point or ignition temperature（ºC） 暂无 ', '11 . Vapor pressure（kPa,25ºC） 暂无 ', '12 . Saturated vapor pressure（kPa,60ºC） 暂无 ', '13 . Combustion heat（KJ/mol）暂无 ', '14 . Critical temperature（ºC） 暂无 ', '15 . Critical pressure（KPa） 暂无 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 暂无 ', '17 . Upper limit of explosion（%,V/V）暂无 ', '18 . Lower limit of explosion（%,V/V） 暂无 ', '19 . Solubility Soluble in Ethyl ether 氯仿二氯甲烷及热苯，难Soluble in 冷 Ethanol and 苯，几乎Insoluble in Water ']
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :28 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :31 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :288 ', '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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