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Computational_Chemistry:
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['1. XlogP :06 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 263 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :881 ', '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 or 浅Yellow Liquid ，具有香兰素and 椰子芳香味。 ', '2 . Density（g/mL,20/4℃）1057 ', '3 . Relative vapor density（g/mL,Atmosphere =1）345 ', '4 . Melting point（ºC）-31 ', '5 . Boiling point（ºC,Atmospheric pressure）207~208 ', '6 . Boiling point（ºC,173kPa）83~84 ', '7 . Refractive index（20ºC）14330 ', '8 . Flash point（ºC）81 ', '9相对. Density（25℃，4℃）10465 ', '10 常温. Refractive index（n25）14303 ', '11 . Vapor pressure（mmHg, ºC）Unknow ', '12 . Saturated vapor pressure（kPa, ºC）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 能与Water 许多有机溶剂树脂and 蜡混溶，Insoluble in 环己烷石油醚甘油等。']
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