|
Refractive_Index:
|
1.529
|
|
Vapor_Pressure:
|
0.0±2.5 mmHg at 25°C
|
|
Flash_Point:
|
235.5±31.5 °C
|
|
LogP:
|
-2.36
|
|
Bolling_Point:
|
465.8±55.0 °C at 760 mmHg
|
|
Water_Solubility:
|
1.2 g/100 mL
|
|
PSA:
|
116.67000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 3105 ', '2 . Molar volume 1006 ', '3 . Parachor （902K）3068 ', '4 . Surface tension 863 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10-24cm3）无可用 ', '7 . Polarizability 1230']
|
|
Computational_Chemistry:
|
['1. XlogP :-46 ', '2. Hydrogen Bond Donor Count :4 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 107 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :162 ', '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']
|
|
Melting_Point:
|
230 °C (dec.)(lit.)
|
|
MF:
|
C3H8NO5P
|
|
Exact_Mass:
|
169.014008
|
|
FW:
|
169.073
|
|
Density:
|
1.7±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance White 晶体。 ', '2 . Density（g/mL,25℃）174 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）230 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,100mmHg）Unknow ', '7 . Refractive index（n 20/D ）1465 ', '8 . Flash point（ºC）230 ', '9 . 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 Soluble in Water ，12g/100mL']
|
