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Bolling_Point:
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281 °C(lit.)
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LogP:
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1.91030
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More_Info:
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['1 . Appearance Colourless to Yellow Liquid 。 ', '2 . Density（g/mL,20/4℃）11362 ', '3 . Melting point（ºC）-3 ', '4 . Boiling point（ºC,Atmospheric pressure）281（部分分解） ', '5 . Refractive index（20ºC）14733 ', '6 . Flash point（ºC）143 ', '7 . Solubility 微Soluble in Water ，与低级芳烃混溶。Soluble in Ethyl ether 丙酮甲醇。能与环烷烯烃and 石蜡部分混溶。']
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Computational_Chemistry:
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['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 425 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :188 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :2 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
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Melting_Point:
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−3 °C(lit.)
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Vapor_Pressure:
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0.00688mmHg at 25°C
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Exact_Mass:
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148.05600
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MF:
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C6H12O2S
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Density:
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1.136 g/mL at 25 °C(lit.)
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Refractive_Index:
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n20/D 1.473(lit.)
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PSA:
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42.52000
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Flash_Point:
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294 °F
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Molecular_Structure:
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['1 . Molar refractive index 3655 ', '2 . Molar volume 1352 ', '3 . Parachor （902K）3114 ', '4 . Surface tension 280 ', '5 . Dielectric constant 不可用 ', '6 偶极距（10-24cm3）不可用 ', '7 . Polarizability 1448']
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FW:
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148.22300
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