Computational_Chemistry:
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['1. XlogP :-79 ', '2. Hydrogen Bond Donor Count 42 ', '3. Hydrogen Bond Acceptor Count 46 ', '4. Rotatable Bond Count :96 ', '5. Isotope Atom Count 1000 ', '6. TPSA ;1160 ', '7. Heavy Atom Count 208 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 6500 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 21 ', '12. Undefined Atom Stereocenter Count 1 ', '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 White or 淡Yellow 粉末 ', '2. Density(g/mL,25/4℃)Unknow ', '3. Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4. Melting point(ºC)Unknow ', '5. Boiling point(ºC,Atmospheric pressure)Unknow ', '6. Boiling point(ºC,52kPa)Unknow ', '7. Refractive indexUnknow ', '8. Flash point(ºC)Unknow ', '9. Specific rotation(º)Unknow ', '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 极易Soluble in Water ,Water 溶液不稳定。']
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