|
Refractive_Index:
|
1.436
|
|
Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
|
|
Flash_Point:
|
92.8±0.0 °C
|
|
LogP:
|
4.12
|
|
Bolling_Point:
|
239.9±19.0 °C at 760 mmHg
|
|
Water_Solubility:
|
不溶
|
|
FW:
|
168.276
|
|
PSA:
|
17.07000
|
|
Vapor_Density:
|
>1 (vs air)
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :2 ', '6. TPSA 171 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :108 ', '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:
|
7°C
|
|
MF:
|
C11H20O
|
|
Exact_Mass:
|
168.151413
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 5292 ', '2 . Molar volume 2025 ', '3 . Parachor （902K）4676 ', '4 . Surface tension 284 ', '5 . Polarizability 2098']
|
|
Density:
|
0.8±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless Liquid 。 ', '2 相对. Density（25℃，4℃）08321d ', '3 相对. Density（20℃，4℃）08356d ', '4 . Melting point（ºC）43 ', '5 . Boiling point（ºC,Atmospheric pressure）337 ', '6 常温. Refractive index（n20）14466d ', '7 常温. Refractive index（n25）14446d ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,70ºC）Unknow ', '12 . Saturated vapor pressure（kPa, ºC）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 Unknow']
|
