Computational_Chemistry:
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['1. XlogP :-13 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 497 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :261 ', '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 无臭透明,具有吸湿性的黏稠Liquid ,有辛辣气味,无腐蚀性。 ', '2 . Boiling point(ºC,1013kPa)245 ', '3 . Melting point(ºC)-105 ', '4 相对. Density(g/mL,20/4ºC)1118 ', '5 . Relative vapor density(g/mL,Atmosphere =1)214 ', '6 . Refractive index(15ºC)14490 ', '7 . Refractive index(20ºC)14472 ', '8 常温. Refractive index(n25)1446 ', '9 黏度(mPa·s,20ºC)357 ', '10 黏度(mPa·s,25ºC)30 ', '11 . Flash point(ºC,闭口)143 ', '12 燃点(ºC)229 ', '13 蒸发热(KJ/mol,bp)52297 ', '14 . Combustion heat(KJ/mol)23802 ', '15 比热容(KJ/(kg·K),20ºC,定压)231 ', '16 电导率(S/m,20ºC)586×10-7 ', '17 . Vapor pressure(kPa,20ºC)<00013 ', '18 体膨胀系数(K-1,20ºC)0000635 ', '19 . Lower limit of explosion(%,V/V)07 ', '20 . Upper limit of explosion(%,V/V)22 ', '21 . Solubility 能与Water Ethanol 乙二醇丙酮氯仿糠醛等混溶。与 Ethyl ether 四氯化碳二硫化碳直链脂肪烃芳香烃等不混溶。 ', '22 相对. Density(25℃,4℃)11122 ', '23 . Critical temperature(ºC)47685 ', '24 . Critical pressure(MPa)47 ', '25 溶度参数(J·cm-3)0527775 ', '26 van der Waals面积(cm2·mol-1)8920×109 ', '27 van der Waals体积(cm3·mol-1)60700 ', '28 气相标准. Combustion heat(焓)(kJ·mol-1)-24320 ', '29 气相标准声称热(焓)( kJ·mol-1) -5712 ', '30 液相标准. Combustion heat(焓)(kJ·mol-1)-23747 ', '31 液相标准声称热(焓)( kJ·mol-1)-6285 ', '32 液相标准热熔(J·mol-1·K-1) 2584']
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