Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 202 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :133 ', '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 :1']
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More_Info:
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['1. Appearance Colourless or Yellow 有苯酚气味晶体or 粉末状,受光变玫瑰色。 ', '2相对. Density(d994) 10989 ', '3. Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4. Melting point(ºC) 96 ', '5. Boiling point(ºC,Atmospheric pressure) 278~280 ', '6晶相相标准. Combustion heat(焓)(kJ·mol-1)-49574 ', '7. Refractive index(n99D) 16224 ', '8气相标准. Combustion heat(焓)(kJ·mol-1)-50486 ', '9气相标准声称热(焓)( kJ·mol-1) -299 ', '10晶相标准声称热(焓)( kJ·mol-1)-1210 ', '11. Vapor pressure(kpa,94ºC)013kPa ', '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 微Soluble in Water ,易Soluble in 苯 Ethanol Ethyl ether 氯仿and 碱性溶液等。 ', '20. Flash point(ºC)125']
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