|
MF:
|
C12H22O11
|
|
Bolling_Point:
|
667.9ºC at 760 mmHg
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|
Exact_Mass:
|
342.11600
|
|
More_Info:
|
['1. Appearance White 的结晶性颗粒or 粉末 ', '2. Density（g/mL,25/4℃）Unknow ', '3相对. Density（20℃，4℃）159 ', '4. Melting point（ºC）Unknow ', '5. Boiling point（ºC,Atmospheric pressure）2295 ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive index525 ° (C=10, H2O) ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º））+520to +526 ', '10晶相相标准. Combustion heat(焓)(kJ·mol-1)-56295 ', '11晶相标准声称热(焓)( kJ·mol-1)-22367 ', '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 Water 中易溶，在 Ethanol 氯仿or Ethyl ether 中不溶。']
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|
Melting_Point:
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201-202ºC
|
|
PSA:
|
189.53000
|
|
Flash_Point:
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357.8ºC
|
|
Density:
|
1.76 g/cm3
|
|
Molecular_Structure:
|
['1. Molar refractive index 708 ', '2. Molar volume 1936 ', '3. Parachor （902K）6283 ', '4. Surface tension 1108 ', '5. Dielectric constant N/A ', '6. Polarizability 2806 ', '7. Single isotope mass 342116212 Da ', '8. Nominal mass 342 Da ', '9. Average mass 3422965 Da']
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|
FW:
|
342.29600
|
|
Computational_Chemistry:
|
['1. XlogP :-47 ', '2. Hydrogen Bond Donor Count :8 ', '3. Hydrogen Bond Acceptor Count :11 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 190 ', '7. Heavy Atom Count :23 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :382 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :10 ', '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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|
Vapor_Pressure:
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1.08E-20mmHg at 25°C
|
