Molecular_Structure:
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['1 . Molar refractive index 3756 ', '2 . Molar volume 1299 ', '3 . Parachor (902K)3037 ', '4 . Surface tension 298 ', '5 . Dielectric constant (20ºC)422 ', '6 偶极距(10-30C·m)333 ', '7 . Polarizability 1489']
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More_Info:
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['1 . Appearance Colourless 油状Liquid ,有芳香味。 ', '2 . Boiling point(ºC,1013kPa)170 ', '3 . Melting point(ºC)-30 ', '4 相对. Density(g/mL,0/4ºC)09852 ', '5 相对. Density(g/mL,202/4ºC)09666 ', '6 . Relative vapor density(g/mL,Atmosphere =1)42 ', '7 . Refractive index(20ºC)15075 ', '8 . Refractive index(25ºC)15049 ', '9 黏度(mPa·s,25ºC)1158 ', '10 黏度(mPa·s,45ºC)0825 ', '11 . Flash point(ºC,闭口)63 ', '12 蒸发热(KJ/mol)4480 ', '13 . Combustion heat(KJ/kg,定压)44234 ', '14 比热容(KJ/(kg·K),20ºC,定压)18672 ', '15 . Critical temperature(ºC)3740 ', '16 . Critical pressure(MPa)34 ', '17 电导率(S/m,25ºC)<17×10-8 ', '18 . Vapor pressure(kPa,20ºC)017 ', '19 . Vapor pressure(kPa,181ºC)013 ', '20 . Solubility Insoluble in Water ,能与醇醚混溶。溶解能力and 苯甲醚相似。 ', '21 相对. Density(20℃,4℃)09651 ', '22 相对. Density(25℃,4℃)09605 ', '23 偏心因子0415 ', '24 溶度参数(J·cm-3)0519393 ', '25 van der Waals面积(cm2·mol-1)9280×109 ', '26 van der Waals体积(cm3·mol-1)72640 ', '27 气相标准. Combustion heat(焓)(kJ·mol-1)-447563 ', '28 气相标准声称热(焓)( kJ·mol-1) -10160 ', '29 液相标准. Combustion heat(焓)(kJ·mol-1)-442459 ', '30 液相标准声称热(焓)( kJ·mol-1)-15264 ', '31 液相标准热熔(J·mol-1·K-1)1201']
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 92 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :65 ', '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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