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More_Info:
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['1 . Appearance 纯品为White 晶体,多数为Colourless or 淡Yellow Liquid 。 ', '2 相对. Density(g/mL,25/4℃)1086 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)21 ', '5 . Boiling point(ºC,Atmospheric pressure)312 ', '6 黏度(mPa·s,18ºC)1059 ', '7 . Refractive index(20ºC)14463 ', '8 . Flash point(ºC,开口)91 ', '9 . Flash point(ºC,闭口)132 ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,175ºC)067 ', '12 . Vapor pressure(kPa,186ºC)187 ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '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 能与醇醚氯仿苯等多种有机溶剂混溶。能溶解氯化橡胶松香乳香虫胶甘油三松香酸酯硝酸纤维素石蜡油聚氯代乙酸乙烯酯等。25℃时在Water 中溶解1%;Water 在酒石酸二丁酯中溶解4%。']
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Computational_Chemistry:
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['1 . XlogP 15 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 6 ', '4 . Rotatable Bond Count 11 ', '5 . Isotope Atom Count ', '6 . TPSA 931 ', '7 . Heavy Atom Count 18 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 227 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 2 ', '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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