More_Info:
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['一物性数据 ', '. Appearance Colourless 流动性Liquid ,在室温时无刺激性,有醚臭 ', '. Density(g/mL,25/4℃)1404 ', '. Relative vapor density(g/mL,Atmosphere =1)不可用 ', '. Melting point(ºC)不可用 ', '. Boiling point(ºC,Atmospheric pressure)62-63 ', '. Boiling point(ºC,52kPa)不可用 ', '. Refractive index1300 ', '. Flash point(ºC)不可用 ', '. Specific rotation(º)不可用 ', '. Spontaneous ignition point or ignition temperature(ºC)不可用 ', '. Vapor pressure(kPa,25ºC)不可用 ', '. Saturated vapor pressure(kPa,60ºC)不可用 ', '. Combustion heat(KJ/mol)不可用 ', '. Critical temperature(ºC)不可用 ', '. Critical pressure(KPa)不可用 ', '. Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 不可用 ', '. Upper limit of explosion(%,V/V)不可用 ', '. Lower limit of explosion(%,V/V)不可用 ', '. Solubility 与 Ethanol Ethyl ether 丙二醇and 卤化溶剂混溶']
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Computational_Chemistry:
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['1. XlogP :23 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 92 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :987 ', '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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