|
Refractive_Index:
|
n20/D 1.417
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|
Vapor_Pressure:
|
0.151mmHg at 25°C
|
|
Flash_Point:
|
91°C
|
|
LogP:
|
2.14840
|
|
Bolling_Point:
|
103-104°C 24mm
|
|
PSA:
|
43.37000
|
|
Molecular_Structure:
|
['1. Molar refractive index 5009 ', '2. Molar volume 1949 ', '3. Parachor （902K）4545 ', '4. Surface tension 295 ', '5. Dielectric constant N/A ', '6. Polarizability 1986 ', '7. Single isotope mass 186125594 Da ', '8. Nominal mass 186 Da ', '9. Average mass 1862481 Da']
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|
Computational_Chemistry:
|
['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 434 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :163 ', '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:
|
-65°C
|
|
MF:
|
C10H18O3
|
|
Exact_Mass:
|
186.12600
|
|
FW:
|
186.24800
|
|
Density:
|
0.932 g/mL at 20 °C(lit.)
|
|
More_Info:
|
['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,25/4℃） 0932 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-65 ', '5 . Boiling point（ºC,Atmospheric pressure）103-104 ', '6 . Boiling point（ºC,52kPa） Unknow ', '7 . Refractive index 1417 ', '8 . Flash point（ºC） 91 ', '9 . Specific rotation（º） Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,25ºC） Unknow ', '12 . Saturated vapor pressure（kPa,60ºC） 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 可Water 解。']
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