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MF:
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C6H6N2O2
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Bolling_Point:
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303.0±42.0 °C at 760 mmHg
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Exact_Mass:
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138.042923
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More_Info:
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['1 . Appearance 浅Yellow 针状结晶or 深棕色粉末。 ', '2 . Density（g/mL,20℃）12～14 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）240℃(分解) ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '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 易Soluble in Ethanol 乙酸乙酸乙酯，Soluble in 热Water ，Insoluble in 冷Water 苯and 汽油。']
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Melting_Point:
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243 °C (dec.)(lit.)
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PSA:
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65.18000
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Flash_Point:
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182.5±17.1 °C
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Refractive_Index:
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1.594
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Density:
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1.3±0.1 g/cm3
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Molecular_Structure:
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['1 . Molar refractive index 3545 ', '2 . Molar volume 1044 ', '3 . Parachor （902K）2820 ', '4 . Surface tension 532 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 1405']
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Computational_Chemistry:
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['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :4 ', '6. TPSA 617 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :110 ', '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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FW:
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138.124
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LogP:
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1.89
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Vapor_Pressure:
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0.0±1.4 mmHg at 25°C
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