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Refractive_Index:
|
n20/D 1.587(lit.)
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Vapor_Pressure:
|
4.23E-06mmHg at 25°C
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Flash_Point:
|
>230 °F
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LogP:
|
3.69490
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Bolling_Point:
|
162-163°C 1mm
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PSA:
|
26.30000
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Molecular_Structure:
|
['1. Molar refractive index 7382 ', '2. Molar volume 2183 ', '3. Parachor （902K）5564 ', '4. Surface tension 421 ', '5. Dielectric constant N/A ', '6. Polarizability 2926 ', '7. Single isotope mass 24011503 Da ', '8. Nominal mass 240 Da ', '9. Average mass 240297 Da']
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Computational_Chemistry:
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['1. XlogP :36 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :246 ', '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']
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|
Melting_Point:
|
162-163ºC
|
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MF:
|
C16H16O2
|
|
Exact_Mass:
|
240.11500
|
|
FW:
|
240.29700
|
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Density:
|
1.1 g/mL at 25 °C(lit.)
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More_Info:
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['1 . Appearance 纯净的Yellow Liquid ', '2 . Density（g/mL, 20 ℃ ） 11 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）162-163 ', '6 . Boiling point（ºC 1mm ）Unknow ', '7 . Refractive indexn20/D1587 ', '8 . Flash point（ºF）>230 ', '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 Unknow']
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