|
Refractive_Index:
|
1.578
|
|
Vapor_Pressure:
|
0.0±0.6 mmHg at 25°C
|
|
Flash_Point:
|
122.9±6.7 °C
|
|
LogP:
|
2.45
|
|
Bolling_Point:
|
266.6±20.0 °C at 760 mmHg
|
|
PSA:
|
29.46000
|
|
Molecular_Structure:
|
['1 . Molar refractive index 5070 ', '2 . Molar volume 1528 ', '3 . Parachor （902K）3819 ', '4 . Surface tension 389 ', '5 . Polarizability 2010']
|
|
Vapor_Density:
|
>1 (vs air)
|
|
Computational_Chemistry:
|
['1 . XlogP 26 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count 3 ', '6 . TPSA 295 ', '7 . Heavy Atom Count 12 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 154 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 1 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
|
|
Melting_Point:
|
-10 °C
|
|
MF:
|
C10H12O2
|
|
Exact_Mass:
|
164.083725
|
|
FW:
|
164.201
|
|
Density:
|
1.1±0.1 g/cm3
|
|
More_Info:
|
['. Appearance 淡Yellow Liquid ，有象丁子香的气味。 . Density（g/mL,20℃）1079~10851 . Relative vapor density（g/mL,Atmosphere =1）Unknow . Melting point（ºC）-10 . Boiling point（ºC,Atmospheric pressure）268 . Boiling point（ºC, KPa）Unknow . Refractive index', '(n', '20', 'D)1575 . Flash point（ºC）112 . Specific rotation（º）Unknow . Spontaneous ignition point or ignition temperature（ºC）: Unknow . Vapor pressure（mmHg,20ºC）<001 . Saturated vapor pressure（kPa, 25ºC）0093 . Combustion heat（KJ/mol）Unknow . Critical temperature（ºC）Unknow . Critical pressure（KPa）Unknow . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow . Upper limit of explosion（%,V/V）Unknow . Lower limit of explosion（%,V/V）Unknow . Solubility 微Soluble in Water ，Soluble in Ethanol Ethyl ether 氯仿丙二醇。']
|
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