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More_Info:
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['1 . Appearance Colourless Liquid ', '2 . Density（g/mL,25/4℃）0992 ', '3 相对. Density（25℃，4℃）0917 ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）102 ', '6 . Boiling point（ºC,52kPa）130 ', '7 常温. Refractive index（n20）14129 ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）＞110 ', '11 气相标准. Combustion heat(焓)(kJ·mol-1)-19016 ', '12 气相标准声称热(焓)( kJ·mol-1) -1364 ', '13 气相标准熵(J·mol-1·K-1) 2851 ', '14 气相标准生成自由能( kJ·mol-1)-688 ', '15 气相标准热熔(J·mol-1·K-1)752 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）21 ', '18 . Lower limit of explosion（%,V/V）38 ', '19 . Solubility Unknow']
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Computational_Chemistry:
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['1. XlogP :13 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 218 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :130 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :1 ', '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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