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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :2 ', '6. TPSA 263 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :154 ', '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 为Colourless to 淡Yellow 油状Liquid ,具有桃子and 杏仁香味。 ', '2 . Density(g/mL,25℃)0944 ', '3 相对. Density(20℃,4℃)08315d ', '4 . Melting point(ºC)25 ', '5 . Boiling point(ºC,Atmospheric pressure)286 ', '6 . Boiling point(ºC,173KPa)136 ', '7 . Refractive index(n/20D)145 ', '8 . Flash point(ºC)137 ', '9相对. Density(25℃,4℃)08278 ', '10 常温. Refractive index(n25)14372 ', '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 Soluble in Ethanol (1mlSoluble in 5mL 60% Ethanol )苄醇苯甲酸苄酯丙二醇碱液大多数非挥发性油and 矿物油,几Insoluble in 甘油and Water 。']
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