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More_Info:
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['1 . Appearance Colourless Liquid ，有芳香气味。 ', '2 . Boiling point（ºC）104 ', '3 . Melting point（ºC）-291 ', '4 相对. Density（g/mL,25/4ºC）11812 ', '5 相对. Density（g/mL,20/4ºC）11884 ', '6 相对. Density（g/mL,30/4ºC）1175 ', '7 . Relative vapor density（g/mL,Atmosphere =1）504 ', '8 . Refractive index（n20ºC）14699 ', '9 . Refractive index（n25ºC）14145 ', '10 运动黏度（m2/s,20ºC）075×10-6 ', '11 运动黏度（m2/s,30ºC）069×10-6 ', '12 . Flash point（闭杯，ºC）22 ', '13 燃点（ºC）无 ', '14 蒸发热（KJ/mol）3395 ', '15 蒸发热（KJ/mol,bp）3266 ', '16 生成热（KJ/mol,气体）-58113 ', '17 生成热（KJ/mol,Liquid ）-618809×103 ', '18 . Combustion heat（KJ/g）-231 ', '19 熔化热（KJ/mol）1379 ', '20 电导率（S/m,25ºC）1×10-7 ', '21 溶解度（%,Water ,室温）0045 ', '22 . Vapor pressure（kPa,55ºC）1992 ', '23 体膨胀系数（K-1,30~40ºC）000121 ', '24 . Solubility Insoluble in Water ，可与醇丙酮苯四氯化碳 Ethyl ether 己烷等混溶。能溶解大多数有机化合物。 ', '25 溶度参数(J·cm-3)0516654 ', '26 van der Waals面积（cm2·mol-1）8780×109 ', '27 van der Waals体积（cm3·mol-1）67170 ', '28 气相标准声称热(焓)( kJ·mol-1) -59915 ', '29 气相标准熵(J·mol-1·K-1) 37270 ', '30 气相标准生成自由能( kJ·mol-1)-51035 ', '31 气相标准热熔(J·mol-1·K-1)13042 ', '32 液相标准声称热(焓)( kJ·mol-1)-63672 ', '33 液相标准熵(J·mol-1·K-1) 27150 ', '34 液相标准生成自由能( kJ·mol-1)-51781 ', '35 液相标准热熔(J·mol-1·K-1)1908']
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Computational_Chemistry:
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['1 . XlogP 3 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 0 ', '5 . Isotope Atom Count ', '6 . TPSA 0 ', '7 . Heavy Atom Count 10 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 999 ', '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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