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Flash_Point:
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204.1ºC
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LogP:
|
0.03620
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|
Bolling_Point:
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471.3ºC at 760 mmHg
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FW:
|
184.10300
|
|
PSA:
|
104.81000
|
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Computational_Chemistry:
|
['1. XlogP -04 ', '2. Hydrogen Bond Donor Count 2 ', '3. Hydrogen Bond Acceptor Count 6 ', '4. Rotatable Bond Count 2 ', '5. Isotope Atom Count N/A ', '6. TPSA 101 ', '7. Heavy Atom Count 13 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 316 ', '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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Melting_Point:
|
265 °C (dec.)(lit.)
|
|
MF:
|
C7H4O6
|
|
Exact_Mass:
|
184.00100
|
|
Molecular_Structure:
|
['1. Molar refractive index 3620 ', '2. Molar volume 1010 ', '3. Parachor （902K）3183 ', '4. Surface tension 984 ', '5. Dielectric constant N/A ', '6. Polarizability 1435 ', '7. Single isotope mass 184000788 Da ', '8. Nominal mass 184 Da ', '9. Average mass 1841031 Da']
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|
Density:
|
1.821 g/cm3
|
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More_Info:
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['1 . Appearance White 结晶粉末 ', '2 . Density（g/mL,25℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）265 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,266kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,20 ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（MPa）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 微Soluble in Ethanol ']
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