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FW:
|
150.23900
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MF:
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C6H14O2S
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Refractive_Index:
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n20/D 1.51(lit.)
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More_Info:
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['1 . Appearance Yellow 粘性Liquid ', '2 . Density（g/mL,25/4℃） 1092 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）无可用 ', '5 . Boiling point（ºC,Atmospheric pressure）140-142/5 mmHg ', '6 . Boiling point（ºC,52kPa） 无可用 ', '7 . Refractive index 151 ', '8 . Flash point（ºC） 无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）110 ', '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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1.28E-05mmHg at 25°C
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Bolling_Point:
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140-142ºC(0.5 torr)
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Exact_Mass:
|
150.07100
|
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PSA:
|
65.76000
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Computational_Chemistry:
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['1. XlogP :02 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 658 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :443 ', '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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Molecular_Structure:
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['1. Molar refractive index 4091 ', '2. Molar volume 1365 ', '3. Parachor （902K）3549 ', '4. Surface tension 456 ', '5. Dielectric constant N/A ', '6. Polarizability 1621 ', '7. Single isotope mass 15007145 Da ', '8. Nominal mass 150 Da ', '9. Average mass 1502392 Da']
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LogP:
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0.48440
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Flash_Point:
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122.6ºC
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Density:
|
1.09
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