|
Refractive_Index:
|
1.485
|
|
Vapor_Pressure:
|
0.0±0.3 mmHg at 25°C
|
|
Flash_Point:
|
126.8±4.9 °C
|
|
LogP:
|
7.46
|
|
Bolling_Point:
|
299.5±3.0 °C at 760 mmHg
|
|
FW:
|
218.378
|
|
More_Info:
|
['1 液相标准热熔(J·mol-1·K-1)4575 ', '2 . Density（g/mL,25℃）0856 ', '3 相对. Density（20℃，4℃）085553 ', '4 . Melting point（ºC）-144 ', '5 . Boiling point（ºC,Atmospheric pressure）293 ', '6 相对. Density（25℃，4℃）085198 ', '7 . Refractive index1482 ', '8 常温. Refractive index（n20）14832 ', '9 常温. Refractive index（n25）14811 ', '10 溶度参数(J·cm-3)0517066 ', '11 van der Waals面积（cm2·mol-1）1950×1010 ', '12 van der Waals体积（cm3·mol-1）150800 ', '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']
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :133 ', '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:
|
−14 °C(lit.)
|
|
MF:
|
C16H26
|
|
Exact_Mass:
|
218.203445
|
|
Molecular_Structure:
|
['1 . Molar refractive index 7286 ', '2 . Molar volume 2543 ', '3 . Parachor （902K）6021 ', '4 . Surface tension 314 ', '5 . Dielectric constant 227 ', '6 偶极距（10-24cm3） ', '7 . Polarizability 2888']
|
|
Density:
|
0.9±0.1 g/cm3
|
