|
Refractive_Index:
|
1.423
|
|
Vapor_Pressure:
|
15.9±0.4 mmHg at 25°C
|
|
Flash_Point:
|
17.7±22.6 °C
|
|
LogP:
|
0.07
|
|
Bolling_Point:
|
105.7±23.0 °C at 760 mmHg
|
|
Water_Solubility:
|
slightly soluble
|
|
PSA:
|
52.32000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 2125 ', '2 . Molar volume 852 ', '3 . Parachor （902K）2052 ', '4 . Surface tension 336 ', '5 . Polarizability 842']
|
|
Vapor_Density:
|
3.07 (vs air)
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :2 ', '6. TPSA 523 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :528 ', '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:
|
48-50 °C(lit.)
|
|
MF:
|
C3H7NO2
|
|
Exact_Mass:
|
89.047676
|
|
FW:
|
89.093
|
|
Density:
|
1.1±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless 无臭晶体or White 结晶性粉末，有像硝石的味道。 ', '2 . Density（g/mL,48/4℃）1045 ', '3 . Relative vapor density（g/mL,Atmosphere =1）307 ', '4 . Melting point（ºC）49 ', '5 . Boiling point（ºC,Atmospheric pressure）182～184 ', '6 . Refractive index（52ºC）14144 ', '7 . Refractive index（50ºC）1424 ', '8 . Refractive index（70ºC）1320 ', '9 . Flash point（ºC）92 ', '10 生成热（KJ/mol）1664 ', '11 . Vapor pressure（kPa,103ºC）720 ', '12 . Vapor pressure（kPa,1207ºC）1440 ', '13 . Vapor pressure（kPa,177ºC）9293 ', '14 溶解度（%,155ºC,Water ）48 ', '15 . Solubility Soluble in Water Ethanol Ethyl ether 氯仿and 甘油，微Soluble in 橄榄油。能溶解除脂肪烃外几乎所有的有机Liquid ，如芳香烃酯类有机酸醇and 醚等。']
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