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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 :11 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :912 ', '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 透明粘稠性Liquid ，or 针状晶体，有特殊气味。 ', '2 . Density（g/mL,20℃）08147 ', '3 . Relative vapor density（g/mL,Atmosphere =1）69 ', '4 . Melting point（ºC）306 ', '5 . Boiling point（ºC,Atmospheric pressure）2784 ', '6 . Boiling point（ºC,14mmHg）153-155 ', '7 . Refractive index(n20D) 14583 ', '8 . Flash point（ºC）1211 ', '9 相对. Density（25℃，4℃）0816550 ', '10 常温. Refractive index（n25）1435150 ', '11 溶度参数(J·cm-3)0518893 ', '12 van der Waals面积（cm2·mol-1）1978×1010 ', '13 van der Waals体积（cm3·mol-1）144470 ', '14 晶相相标准. Combustion heat(焓)(kJ·mol-1)-85178 ', '15 晶相标准声称热(焓)( kJ·mol-1)-5994 ', '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 Insoluble in Water ，可Soluble in 有机溶剂']
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