Computational_Chemistry:
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['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :929 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '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 Colourless Liquid ,有扁桃香气,以及花香and 干草香调,带有薄荷气息。 ', '2相对. Density(d204) 0987 ', '3 . Relative vapor density(g/cm3,Atmosphere =1)47 ', '4 . Melting point(ºC)81-82 ', '5 . Boiling point(ºC,Atmospheric pressure)218~220 ', '6 . Boiling point(ºC,8kPa)Unknow ', '7 . Refractive index(n20D) 15246 ', '8 . Flash point(ºC)107 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(mm Hg,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,551ºC)Unknow ', '13 . Combustion heat(KJ/mol)478 ', '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 ']
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