Molecular_Structure:
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['1. Molar refractive index 3616 ', '2. Molar volume 1071 ', '3. Parachor (902K)2994 ', '4. Surface tension 61 ', '5. Dielectric constant N/A ', '6. Polarizability 1433 ', '7. Single isotope mass 156993056 Da ', '8. Nominal mass 157 Da ', '9. Average mass 1575545 Da']
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Flash_Point:
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136.4±22.3 °C
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Refractive_Index:
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1.590
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FW:
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157.555
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Density:
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1.5±0.1 g/cm3
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Bolling_Point:
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301.9±22.0 °C at 760 mmHg
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Computational_Chemistry:
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['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 502 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :140 ', '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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LogP:
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0.14
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Melting_Point:
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139-143 °C
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PSA:
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50.19000
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MF:
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C6H4ClNO2
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More_Info:
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['1 . Appearance 奶油色-Yellow 粉末。 ', '2 . Density(g/mL,25/4℃) 无可用 ', '3 . Relative vapor density(g/mL,Atmosphere =1)无可用 ', '4 . Melting point(ºC)139-143 ', '5 . Boiling point(ºC,Atmospheric pressure)无可用 ', '6 . Boiling point(ºC,52kPa) 无可用 ', '7 . Refractive index 无可用 ', '8 . Flash point(ºC) 无可用 ', '9 . Specific rotation(º) 无可用 ', '10 . Spontaneous ignition point or ignition temperature(ºC) 无可用 ', '11 . Vapor pressure(kPa,25ºC) 无可用 ', '12 . Saturated vapor pressure(kPa,60ºC) 无可用 ', '13 . Combustion heat(KJ/mol)无可用 ', '14 . Critical temperature(ºC) 无可用 ', '15 . Critical pressure(KPa) 无可用 ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion(%,V/V)无可用 ', '18 . Lower limit of explosion(%,V/V) 无可用 ', '19 . Solubility 无可用。']
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Vapor_Pressure:
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0.0±0.7 mmHg at 25°C
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Exact_Mass:
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156.993057
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