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Molecular_Structure:
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['1. Molar refractive index N/A ', '2. Molar volume N/A ', '3. Parachor （902K）N/A ', '4. Surface tension N/A ', '5. Dielectric constant N/A ', '6. Polarizability N/A ', '7. Single isotope mass 328844507 Da ', '8. Nominal mass 329 Da ', '9. Average mass 3292443 Da']
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|
Water_Solubility:
|
464 g/L (20 ºC)
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FW:
|
329.24400
|
|
Density:
|
1.85
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Bolling_Point:
|
25.7ºC at 760 mmHg
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|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :12 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 143 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :127 ', '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 :10']
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LogP:
|
0.09818
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|
Melting_Point:
|
°Cd ec.)
|
|
PSA:
|
142.74000
|
|
MF:
|
C6FeK3N6
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|
More_Info:
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['1 . Appearance 深红色or 红色单斜晶系柱状结晶or 粉末。 ', '2 . Density（g/mL,25/4℃）185 ', '3 . Solubility Soluble in 25份冷Water 13份沸Water 及丙酮，Insoluble in Ethanol 。遇阳光or Soluble in Water 都不稳定，能被酸分解。遇亚铁盐生成深蓝色沉淀。']
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Exact_Mass:
|
328.84500
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