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 :7 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :713 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '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 or 淡Yellow Liquid 。 ', '2 . Density(g/mL,25/4℃) 08230 ', '3 相对. Density(20℃,4℃)08266 ', '4 . Melting point(ºC)-5 ', '5 . Boiling point(ºC,Atmospheric pressure)10510 ', '6 常温. Refractive index(n20)1434 ', '7 . Refractive index 14345 ', '8 . Flash point(ºC) 99 ', '9 常温. Refractive index(n25)1432 ', '10 . Spontaneous ignition point or ignition temperature(ºC) Unknow ', '11 . Vapor pressure(kPa,25ºC) Unknow ', '12 . Saturated vapor pressure(kPa,60ºC) Unknow ', '13 . Critical temperature(ºC)39295 ', '14 临界. Density(g·cm-3)0246 ', '15 临界体积(cm3·mol-1)643 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V) Unknow ', '19 . Solubility Insoluble in Water ,Soluble in 油脂']
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