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Molecular_Structure:
|
['1. Molar refractive index 6028 ', '2. Molar volume 1887 ', '3. Parachor （902K）5474 ', '4. Surface tension 707 ', '5. Dielectric constant N/A ', '6. Polarizability 2389 ', '7. Single isotope mass 262116486 Da ', '8. Nominal mass 262 Da ', '9. Average mass 2622597 Da']
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LogP:
|
-1.77
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Flash_Point:
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279.0±30.1 °C
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Refractive_Index:
|
1.552
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FW:
|
262.260
|
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Density:
|
1.4±0.1 g/cm3
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|
Bolling_Point:
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537.8±50.0 °C at 760 mmHg
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Computational_Chemistry:
|
['1 . XlogP -53 ', '2 . Hydrogen Bond Donor Count 4 ', '3 . Hydrogen Bond Acceptor Count 8 ', '4 . Rotatable Bond Count 10 ', '5 . Isotope Atom Count ', '6 . TPSA 141 ', '7 . Heavy Atom Count 18 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 291 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 1 ', '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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|
PSA:
|
141.16000
|
|
MF:
|
C10H18N2O6
|
|
More_Info:
|
['1 . Appearance 粉末 ', '2 . Density（g/mL,25ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC）70-80 ', '6 . Boiling point（ºC，035mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（°C）Unknow ', '9 . Specific rotation（ºF）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa,110ºC）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 Unknow']
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|
Vapor_Pressure:
|
0.0±3.1 mmHg at 25°C
|
|
Exact_Mass:
|
262.116486
|
