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Molecular_Structure:
|
['1. Molar refractive index 462 ', '2. Molar volume 1407 ', '3. Parachor （902K）367 ', '4. Surface tension 462 ', '5. Dielectric constant N/A ', '6. Polarizability 1831 ', '7. Single isotope mass 209930905 Da ', '8. Nominal mass 210 Da ', '9. Average mass 2110658 Da']
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LogP:
|
2.84150
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Flash_Point:
|
109.4ºC
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|
Refractive_Index:
|
1.563
|
|
FW:
|
211.06600
|
|
Density:
|
1.5g/cm3
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|
Bolling_Point:
|
257.3ºC at 760mmHg
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Computational_Chemistry:
|
['1. XlogP :34 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 545 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :165 ', '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:
|
54.54000
|
|
MF:
|
C6H4Cl2O2S
|
|
More_Info:
|
['1 . Appearance Colourless or Yellow Liquid ', '2 . Density（g/mL, 20 ℃ ） Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC 06mmHg）74-75 ', '7 . Refractive index15630 ', '8 . Flash point（ºC）74-75 ', '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 不能拌and 难以拌and ']
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|
Vapor_Pressure:
|
0.0146mmHg at 25°C
|
|
Exact_Mass:
|
209.93100
|
