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More_Info:
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['1 . Appearance Colourless 透明Liquid ，具有Water 果芬芳香气。 ', '2 . Boiling point（ºC,1013kPa）1570 ', '3 . Boiling point（ºC,667kPa）88 ', '4 . Boiling point（ºC,133kPa）60 ', '5 相对. Density（g/mL,25/4ºC）0814 ', '6 . Refractive index（n20ºCD）14181 ', '7 黏度（mPa·s,20ºC）52 ', '8 . Flash point（ºC,开口）60 ', '9 蒸发热（KJ/kg）4586 ', '10 熔化热（KJ/kg）15064 ', '11 生成热（KJ/mol）-38782 ', '12 比热容（KJ/(kg·K),13ºC,定压）209 ', '13 . Critical temperature（ºC）452 ', '14 热导率（W/(m·K),20ºC）163 ', '15 凝固点（ºC）-446 ', '16 溶解度（%,Water ,20ºC）058 ', '17 . Lower limit of explosion（%,V/V）12 ', '18 . Upper limit of explosion（%,V/V）77 ', '19 体膨胀系数（K-1）000070 ', '20 . Solubility 能与 Ethanol and Ethyl ether 混溶，微Soluble in Water ，也可Soluble in 多种有机溶剂。 ', '21 . Melting point（ºC）-474 ', '22 相对. Density（25℃，4℃）08162 ', '23 常温. Refractive index（n25）14161 ', '24 . Critical pressure（MPa）3417 ', '25 临界. Density（g·cm-3）0264 ', '26 临界体积（cm3·mol-1）387 ', '27 临界压缩因子0261 ', '28 偏心因子0580 ', '29 溶度参数(J·cm-3)0521488 ', '30 van der Waals面积（cm2·mol-1）1033×1010 ', '31 van der Waals体积（cm3·mol-1）72860 ', '32 气相标准. Combustion heat(焓)(kJ·mol-1)404622 ', '33 气相标准声称热(焓)( kJ·mol-1) -31564 ', '34 气相标准熵(J·mol-1·K-1) 4414 ', '35 气相标准生成自由能( kJ·mol-1)-13393 ', '36 液相标准. Combustion heat(焓)(kJ·mol-1)-398437 ', '37 液相标准声称热(焓)( kJ·mol-1)-37750 ', '38 液相标准熵(J·mol-1·K-1) 2895 ', '39 液相标准生成自由能( kJ·mol-1)-15468 ', '40 液相标准热熔(J·mol-1·K-1)2196']
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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 :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :274 ', '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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