|
MF:
|
C5H10O
|
|
Bolling_Point:
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127.3±8.0 °C at 760 mmHg
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Exact_Mass:
|
86.073166
|
|
More_Info:
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['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）无可用 5 . Boiling point（ºC,Atmospheric pressure）135 6 常温. Refractive index（n ', '25）14327 7 . Refractive index14355 ', '8 . Flash point（ºC）47 ', '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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PSA:
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20.23000
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Flash_Point:
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42.0±8.6 °C
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Refractive_Index:
|
1.471
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Density:
|
1.0±0.1 g/cm3
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|
Molecular_Structure:
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['1 . Molar refractive index 2469 ', '2 . Molar volume 883 ', '3 . Parachor （902K）2209 ', '4 . Surface tension 391 ', '5 . Polarizability 979']
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Computational_Chemistry:
|
['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :392 ', '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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FW:
|
86.132
|
|
LogP:
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0.71
|
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Vapor_Pressure:
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5.1±0.5 mmHg at 25°C
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