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Refractive_Index:
|
1.421
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|
Vapor_Pressure:
|
0.1±0.9 mmHg at 25°C
|
|
Flash_Point:
|
93.3±0.0 °C
|
|
LogP:
|
-0.57
|
|
Bolling_Point:
|
204.0±23.0 °C at 760 mmHg
|
|
PSA:
|
37.30000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 2677 ', '2 . Molar volume 1056 ', '3 . Parachor （902K）2528 ', '4 . Surface tension 327 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1061']
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|
Computational_Chemistry:
|
['1. XlogP :-04 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :3 ', '6. TPSA 373 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :591 ', '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']
|
|
MF:
|
C5H10O2
|
|
Exact_Mass:
|
102.068077
|
|
FW:
|
102.132
|
|
Density:
|
1.0±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless 透明Liquid ', '2 . Density（g/mL,25℃）1007 ', '3 相对. Density（20℃，4℃）099997 ', '4 相对. Density（25℃，4℃）0993 ', '5 . Boiling point（ºC,Atmospheric pressure）11733 ', '6 . Boiling point（ºC,100mmHg）144-145 ', '7 . Refractive index（n 20/D ）14415 ', '8 . Flash point（ºF）200 ', '9 常温. Refractive index（n25）14350 ', '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 与Water 混溶，Soluble in Ethanol and Ethyl ether ']
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