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 :10 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :812 ', '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 淡Yellow 油状Liquid or Solid ,在乙酸中结晶为片状。略具有月下香及紫罗兰的香气,具有颇弱但很持久的油脂气息。 ', '2 相对. Density(g/mL,24/4℃)08309 ', '3 . Melting point(ºC)24 ', '4 . Boiling point(ºC)259 ', '5 . Boiling point(ºC, 199983KPa)150 ', '6 . Refractive index(20ºC)14282 ', '7 . Flash point(ºC,闭口)>100 ', '8 黏度(mPa·s,20ºC)115 ', '9. Vapor pressure(kPa, 91ºC)013 ', '10 凝固点(ºC)2395 ', '11 . Solubility Insoluble in Water ,Soluble in Ethanol Ethyl ether 。 ', '12 相对. Density(20℃,4℃)08343 ', '13 相对. Density(25℃,4℃)08308 ', '14 常温. Refractive index(n20)14428 ', '15 常温. Refractive index(n25)14413 ', '16 . Critical temperature(ºC)44625 ', '17 . Critical pressure(MPa)1994 ', '18 偏心因子0693 ', '19 溶度参数(J·cm-3)0519485 ', '20 van der Waals面积(cm2·mol-1)1843×1010 ', '21 van der Waals体积(cm3·mol-1)134240 ', '22 气相标准. Combustion heat(焓)(kJ·mol-1)-800136 ', '23 气相标准声称热(焓)( kJ·mol-1) -43652 ', '24 液相标准. Combustion heat(焓)(kJ·mol-1)-790939 ', '25 液相标准声称热(焓)( kJ·mol-1)-52848 ', '26 液相标准热熔(J·mol-1·K-1)4932']
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