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FW:
|
192.124
|
|
MF:
|
C6H8O7
|
|
Water_Solubility:
|
750 g/L (20 ºC)
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|
Refractive_Index:
|
1.575
|
|
Vapor_Pressure:
|
0.0±1.5 mmHg at 25°C
|
|
Bolling_Point:
|
309.6±42.0 °C at 760 mmHg
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|
Exact_Mass:
|
192.027008
|
|
PSA:
|
132.13000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :4 ', '3. Hydrogen Bond Acceptor Count :7 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :N/A ', '6. TPSA 132 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :227 ', '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:
|
['1 . Molar refractive index 3604 ', '2 . Molar volume 1090 ', '3 . Parachor （902K）3480 ', '4 . Surface tension 1039 ', '5 . Polarizability 1428']
|
|
LogP:
|
-1.72
|
|
Melting_Point:
|
153-159 °C(lit.)
|
|
Flash_Point:
|
155.2±24.4 °C
|
|
Density:
|
1.8±0.1 g/cm3
|
|
More_Info:
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['1 . Appearance White 半透明晶体or 粉末，具有令人愉快的酸味。 ', '2 . Density（g/mL,25/4℃）1665（无Water 物） ', '3 相对. Density（20℃，4℃）1665 ', '4 . Melting point（ºC）153（无Water 物） ', '5 晶相相标准. Combustion heat(焓)(kJ·mol-1)-19606 ', '6 晶相标准声称热(焓)( kJ·mol-1)-15438 ', '7 . Refractive index1493～1509 ', '8 . Specific rotation（º）不确定 ', '9 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '10. Vapor pressure（kPa,25ºC）不确定 ', '11 . Saturated vapor pressure（kPa,60ºC）不确定 ', '12 . Combustion heat（KJ/mol）不确定 ', '13 . Critical temperature（ºC）不确定 ', '14 . Critical pressure（KPa）不确定 ', '15 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '16 . Upper limit of explosion（%,V/V）不确定 ', '17 . Lower limit of explosion（%,V/V）不确定 ', '18 . Solubility 易Soluble in Water and Ethanol ，Soluble in Ethyl ether 。 ', '19 . Flash point（ºC）100']
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