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Bolling_Point:
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249.0±0.0 °C at 760 mmHg
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Vapor_Pressure:
|
0.0±0.5 mmHg at 25°C
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More_Info:
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['1 . Appearance 灰Yellow Liquid 。 ', '2 . Density（g/mL,25℃）108 ', '3 相对. Density（20℃，4℃）10821 ', '4 . Melting point（ºC）135~14 ', '5 . Boiling point（ºC,Atmospheric pressure）255~256 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index(n20D) 15301 ', '8 . Flash point（ºC）75 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,20ºC）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 Insoluble in Water ，Soluble in Ethanol Ethyl ether 苯等。']
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LogP:
|
2.23
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|
Density:
|
1.1±0.1 g/cm3
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|
Computational_Chemistry:
|
['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :115 ', '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:
|
13-14 °C(lit.)
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|
Exact_Mass:
|
150.068085
|
|
MF:
|
C9H10O2
|
|
Refractive_Index:
|
1.538
|
|
PSA:
|
26.30000
|
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Flash_Point:
|
112.6±13.4 °C
|
|
Molecular_Structure:
|
['1. Molar refractive index 4431 ', '2. Molar volume 1416 ', '3. Parachor （902K）3487 ', '4. Surface tension 368 ', '5. Dielectric constant N/A ', '6. Polarizability 1756 ', '7. Single isotope mass 15006808 Da ', '8. Nominal mass 150 Da ', '9. Average mass 1501745 Da']
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|
FW:
|
150.174
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