Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :10 ', '6. TPSA 415 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :829 ', '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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More_Info:
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['1 . Appearance White 菱形结晶。 ', '2 . Density(g/mL, 25 ℃ )1290 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)58 ', '5 . Boiling point(ºC,Atmospheric pressure)289-290 ', '6 . Boiling point(ºC,267KPa)165-170 ', '7 . Boiling point(ºC,067KPa)147 ', '8 . Refractive indexUnknow ', '9 . Flash point(º F)Unknow ', '10 . Specific rotation(º)Unknow ', '11 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '12 . Vapor pressure(kPa,25ºC)Unknow ', '13 . Saturated vapor pressure(kPa,60ºC)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 易Soluble in Water 醇and 醚,略Soluble in 苯,微Soluble in 氯仿and 二硫化碳。']
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