|
MF:
|
C15H15N
|
|
Bolling_Point:
|
333.7±35.0 °C at 760 mmHg
|
|
Exact_Mass:
|
209.120453
|
|
More_Info:
|
['1 . Appearance 浅褐色粉末 ', '2 . Density（g/mL,25ºC）07 ', '3 . Density（g/cm3） 106 ', '4 . Melting point（ºC）111-117 ', '5 . Boiling point（ºC，760mm hg）3337 ', '6 . Boiling point（ºC，20mm hg）Unknow ', '7 . Solubility （20ºC）Insoluble in Water ', '8 . Flash point（ºC）147 ', '9. Spontaneous ignition point or ignition temperature（ºC） Unknow ', '10 . Vapor pressure（kPa,25ºC）Unknow ', '11 . Saturated vapor pressure（kPa,60ºC）Unknow ', '12 . Combustion heat（KJ/mol）Unknow ', '13 . Critical temperature（ºC）Unknow ', '14 . Critical pressure（KPa）Unknow ', '15 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '16 . Upper limit of explosion（%,V/V）Unknow ', '17 . Lower limit of explosion（%,V/V）Unknow']
|
|
Melting_Point:
|
111-117ºC
|
|
PSA:
|
12.36000
|
|
Flash_Point:
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147.7±26.8 °C
|
|
Refractive_Index:
|
1.600
|
|
Density:
|
1.1±0.1 g/cm3
|
|
Molecular_Structure:
|
['1 . Molar refractive index 6705 ', '2 . Molar volume 1959 ', '3 . Parachor （902K）4811 ', '4 . Surface tension 363 ', '5 . Polarizability 2658']
|
|
Computational_Chemistry:
|
['1. XlogP :35 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 124 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :315 ', '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']
|
|
FW:
|
209.286
|
|
LogP:
|
3.00
|
|
Vapor_Pressure:
|
0.0±0.7 mmHg at 25°C
|
