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Computational_Chemistry:
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['1. XlogP :28 ', '2. Hydrogen Bond Donor Count 1 ', '3. Hydrogen Bond Acceptor Count 1 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count ', '6. TPSA :202 ', '7. Heavy Atom Count 9 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 525 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 1 ', '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 Liquid 。呈强烈油脂果仁and 草药香昧，稀释后呈蘑菇香气and 干酪香味。 ', '2. Density（g/mL,25/4℃）08176 ', '3相对. Density（20℃，4℃）08216 ', '4. Melting point（ºC）-450 ', '5. Boiling point（ºC,Atmospheric pressure）1747 ', '6常温. Refractive index（n20）1423 ', '7. Refractive index1426 ', '8. Flash point（ºC）150 ', '9常温. Refractive index（n25）1421 ', '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 Unknow']
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