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More_Info:
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['1 . Appearance White or 微Yellow 膏状体or Solid 。 ', '2 . Density（g/mL,30℃）044 ', '3 相对. Density（20ºC/4 ºC）0968 ', '4 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '5 . Melting point（ºC）232-234 ', '6 . Boiling point（ºC,133kpa）Unknow ', '7 . Boiling point（ºC,52kPa）Unknow ', '8 . Refractive index1377 ', '9 . Flash point（ºC）100 ', '10 . Specific rotation（º）Unknow ', '11 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '12 . Vapor pressure（mmHg,ºC）Unknow ', '13 . Saturated vapor pressure（kPa, ºC）Unknow ', '14 . Combustion heat（KJ/mol）Unknow ', '15 . Critical temperature（ºC）Unknow ', '16 . Critical pressure（KPa）Unknow ', '17 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '18 . Upper limit of explosion（%,V/V）Unknow ', '19 . Lower limit of explosion（%,V/V）Unknow ', '20 . Solubility 具有Water 溶性。']
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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 :1 ', '4. Rotatable Bond Count :15 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :21 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :181 ', '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 :2']
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