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Molecular_Structure:
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['1. Molar refractive index 4048 ', '2. Molar volume 1527 ', '3. Parachor (902K)3714 ', '4. Surface tension 349 ', '5. Dielectric constant N/A ', '6. Polarizability 1605 ', '7. Single isotope mass 164060407 Da ', '8. Nominal mass 164 Da ', '9. Average mass 1646299 Da']
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LogP:
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1.04
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Flash_Point:
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78.9±15.6 °C
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Refractive_Index:
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1.443
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FW:
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164.630
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Density:
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1.1±0.1 g/cm3
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Bolling_Point:
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218.9±15.0 °C at 760 mmHg
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Computational_Chemistry:
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['1. XlogP :15 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 185 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :817 ', '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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PSA:
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18.46000
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MF:
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C7H13ClO2
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More_Info:
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['1 . Appearance Liquid ', '2 . Density(g/mL,25ºC)1109 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC<SPAN style="FONT-SIZE: 9pt; FONT-FAMILY: 宋体; mso-font-kerning: 0pt; mso-ascii-font-family: Arial; mso-hans']
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Vapor_Pressure:
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0.2±0.4 mmHg at 25°C
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Exact_Mass:
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164.060410
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