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Molecular_Structure:
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['1 . Molar refractive index 3537 ', '2 . Molar volume （m3/mol）1354 ', '3 . Parachor （902K）3263 ', '4 . Surface tension 337 ', '5 . Polarizability 1402']
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Flash_Point:
|
>230 °F
|
|
Refractive_Index:
|
n20/D 1.442(lit.)
|
|
FW:
|
145.15600
|
|
Density:
|
1.068 g/mL at 25 °C(lit.)
|
|
Bolling_Point:
|
105-106 °C7 mm Hg(lit.)
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|
Computational_Chemistry:
|
['1. XlogP :04 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 466 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :142 ', '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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|
PSA:
|
46.61000
|
|
MF:
|
C6H11NO3
|
|
More_Info:
|
['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）1068g/mLat 25°C(lit)3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）Unknow ', '5. Boiling point（ºC,Atmospheric pressure）105-106°C7mm Hg(lit)6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexn 20/D 1442(lit) ', '8. Flash point（ºC）>230°F9. Specific rotation（º）Unknow ', '10. Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11. Vapor pressure（kPa,25ºC）Unknow ', '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 Unknow']
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|
Vapor_Pressure:
|
1.09mmHg at 25°C
|
|
Exact_Mass:
|
145.07400
|
