|
FW:
|
186.291
|
|
MF:
|
C11H22O2
|
|
Refractive_Index:
|
1.427
|
|
Vapor_Pressure:
|
0.1±0.4 mmHg at 25°C
|
|
Bolling_Point:
|
224.0±0.0 °C at 760 mmHg
|
|
Exact_Mass:
|
186.161987
|
|
PSA:
|
26.30000
|
|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :121 ', '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']
|
|
Molecular_Structure:
|
['五分子性质数据 ', '1 . Molar refractive index 5478 ', '2 . Molar volume 2135 ', '3 . Parachor （902K）4945 ', '4 . Surface tension 287 ', '5 . Polarizability 2171']
|
|
LogP:
|
4.43
|
|
Melting_Point:
|
−14-−11 °C(lit.)
|
|
Flash_Point:
|
94.4±0.0 °C
|
|
Density:
|
0.9±0.1 g/cm3
|
|
More_Info:
|
['1 . Appearance Colourless 透明油状Liquid 。 ', '2 . Density（g/mL,25℃）0873 ', '3 相对. Density（20℃，4℃）08730 ', '4 . Melting point（ºC）-18 ', '5 . Boiling point（ºC,Atmospheric pressure）224， 108ºC（1333pa） ', '6 相对. Density（25℃，4℃）0839960 ', '7 . Refractive index(n20D)1425 ', '8 . Flash point（ºC）94 ', '9 常温. Refractive index（n20）14259 ', '10 气相标准. Combustion heat(焓)(kJ·mol-1)-689896 ', '11 气相标准声称热(焓)( kJ·mol-1) -57379 ', '12 液相标准. Combustion heat(焓)(kJ·mol-1)-683222 ', '13 液相标准声称热(焓)( kJ·mol-1)-64053 ', '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 Soluble in Ethanol Ethyl ether and 苯，Insoluble in Water 。']
|
