|
Refractive_Index:
|
1.509
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|
Vapor_Pressure:
|
0.2±0.4 mmHg at 25°C
|
|
Flash_Point:
|
72.0±15.6 °C
|
|
LogP:
|
3.04
|
|
Bolling_Point:
|
208.3±9.0 °C at 760 mmHg
|
|
FW:
|
163.259
|
|
PSA:
|
3.24000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 32 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :102 ', '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']
|
|
MF:
|
C11H17N
|
|
Exact_Mass:
|
163.136093
|
|
Molecular_Structure:
|
['1 . Molar refractive index 5342 ', '2 . Molar volume 1790 ', '3 . Parachor （902K）4289 ', '4 . Surface tension 329 ', '5 . Dielectric constant ', '6 偶极距（10-24cm3） ', '7 . Polarizability 2117']
|
|
Density:
|
0.9±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless Liquid ，有杏仁味。 ', '2 . Density（g/mL,20/4℃）0890 ', '3 . Boiling point（ºC,Atmospheric pressure）211~212 ', '4 . Refractive index（20ºC）15002 ', '5 . Flash point（ºC,开口）77 ', '6 . Vapor pressure（kPa,94ºC）120 ', '7 苦味酸盐. Melting point（ºC）120 ', '8. Solubility Insoluble in Water ，Soluble in 甲醇 Ethanol Ethyl ether 丙酮乙酸乙酯芳香烃油酸等。']
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