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More_Info:
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['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）0821 ', '3 . Relative vapor density（g/mL,Atmosphere =1）28 ', '4 溶度参数(J·cm-3)0515162 ', '5 . Boiling point（ºC,Atmospheric pressure）127-128/766mm Hg 6 van der Waals面积（cm ', '2·mol ', '-1）7750×10 ', '9 7 . Refractive index1424 ', '8 van der Waals体积（cm3·mol-1）54510 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（K）20185 ', '15 . Critical pressure（MPa）369 ', '16 偏心因子0241 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
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Computational_Chemistry:
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['1. XlogP :12 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :834 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :1 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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