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Computational_Chemistry:
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['1. Hydrogen Bond Donor Count 0 ', '2. Hydrogen Bond Acceptor Count 5 ', '3. Rotatable Bond Count 0 ', '4. TPSA 641 ', '5. Heavy Atom Count 11 ', '6. Topological Polar Surface Area 0 ', '7. Complexity 964 ', '8. Isotope Atom Count 0 ', '9. Defined Atom Stereocenter Count 0 ', '10. Undefined Atom Stereocenter Count 0 ', '11. Defined Bond Stereocenter Count 0 ', '12. Undefined Bond Stereocenter Count 0 ', '13. Covalently-Bonded Unit Count 4']
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More_Info:
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['1. Appearance 橙Yellow 结晶 ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）205 ', '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 Insoluble in 二氯甲烷,苯and Ethyl ether ；Soluble in 丙酮乙腈and THF。']
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